USER MOD reduce.3.24.130724 H: found=0, std=0, add=928, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 928 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: E 16 GLN : amide:sc=-0.00983 K(o=-0.35,f=0.81) USER MOD Set 1.2: E 31 ASN : amide:sc= -0.34 K(o=-0.35,f=-1.6!) USER MOD Set 2.1: D 31 ASN : amide:sc= -0.201 X(o=-0.48,f=-0.31) USER MOD Set 2.2: D 35 HIS : no HD1:sc= -0.283 X(o=-0.48,f=-0.97) USER MOD Single : D 3 GLN : amide:sc= -0.0959 X(o=-0.096,f=0) USER MOD Single : D 6 THR OG1 : rot 180:sc= 0.00508 USER MOD Single : D 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 10 TYR OH : rot 180:sc= 0 USER MOD Single : D 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : D 17 THR OG1 : rot 180:sc= 0 USER MOD Single : D 18 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0189) USER MOD Single : D 19 THR OG1 : rot -77:sc= 1.57 USER MOD Single : D 21 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0405) USER MOD Single : D 26 TYR OH : rot 180:sc= 0 USER MOD Single : D 27 GLN : amide:sc= -2.56! K(o=-2.6!,f=-1.6) USER MOD Single : D 28 SER OG : rot 180:sc= 0.0271 USER MOD Single : D 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : D 43 THR OG1 : rot 139:sc= 1.27 USER MOD Single : D 45 ASN : amide:sc= -2.33! K(o=-2.3!,f=-0.98) USER MOD Single : D 49 SER OG : rot 180:sc= 0 USER MOD Single : D 51 TYR OH : rot 180:sc= 0 USER MOD Single : D 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 3 GLN : amide:sc= -0.779 K(o=-0.78,f=0) USER MOD Single : E 6 THR OG1 : rot 112:sc= 0.0395 USER MOD Single : E 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 10 TYR OH : rot -113:sc= 0.011 USER MOD Single : E 12 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : E 17 THR OG1 : rot 180:sc= 0 USER MOD Single : E 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 19 THR OG1 : rot -72:sc= 1.79 USER MOD Single : E 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : E 26 TYR OH : rot 180:sc= 0 USER MOD Single : E 27 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : E 28 SER OG : rot 180:sc= 0 USER MOD Single : E 32 LYS NZ :NH3+ -105:sc= -0.0868 (180deg=-0.627) USER MOD Single : E 35 HIS : no HD1:sc= -3.45! C(o=-3.5!,f=-2.8!) USER MOD Single : E 39 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0264) USER MOD Single : E 43 THR OG1 : rot 180:sc= 0 USER MOD Single : E 45 ASN : amide:sc= -0.642 K(o=-0.64,f=-4.4!) USER MOD Single : E 49 SER OG : rot 180:sc= 0 USER MOD Single : E 51 TYR OH : rot 180:sc= 0 USER MOD Single : E 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 20 N GLU D 2 -21.869 17.621 -10.308 1.00 0.00 N ATOM 21 CA GLU D 2 -20.691 16.727 -10.127 1.00 0.00 C ATOM 22 C GLU D 2 -21.168 15.290 -9.913 1.00 0.00 C ATOM 23 O GLU D 2 -21.338 14.843 -8.795 1.00 0.00 O ATOM 24 CB GLU D 2 -19.885 17.185 -8.910 1.00 0.00 C ATOM 25 CG GLU D 2 -20.840 17.610 -7.793 1.00 0.00 C ATOM 26 CD GLU D 2 -20.195 17.330 -6.434 1.00 0.00 C ATOM 27 OE1 GLU D 2 -19.053 16.903 -6.418 1.00 0.00 O ATOM 28 OE2 GLU D 2 -20.856 17.548 -5.431 1.00 0.00 O ATOM 0 HA GLU D 2 -20.062 16.771 -11.016 1.00 0.00 H new ATOM 0 HB2 GLU D 2 -19.240 16.378 -8.563 1.00 0.00 H new ATOM 0 HB3 GLU D 2 -19.236 18.017 -9.183 1.00 0.00 H new ATOM 0 HG2 GLU D 2 -21.074 18.671 -7.884 1.00 0.00 H new ATOM 0 HG3 GLU D 2 -21.781 17.067 -7.879 1.00 0.00 H new ATOM 35 N GLN D 3 -21.386 14.562 -10.973 1.00 0.00 N ATOM 36 CA GLN D 3 -21.852 13.155 -10.826 1.00 0.00 C ATOM 37 C GLN D 3 -20.647 12.236 -10.614 1.00 0.00 C ATOM 38 O GLN D 3 -20.138 11.641 -11.542 1.00 0.00 O ATOM 39 CB GLN D 3 -22.599 12.731 -12.093 1.00 0.00 C ATOM 40 CG GLN D 3 -23.647 11.675 -11.740 1.00 0.00 C ATOM 41 CD GLN D 3 -24.736 11.655 -12.815 1.00 0.00 C ATOM 42 OE1 GLN D 3 -25.610 12.499 -12.827 1.00 0.00 O ATOM 43 NE2 GLN D 3 -24.719 10.721 -13.727 1.00 0.00 N ATOM 0 H GLN D 3 -21.262 14.880 -11.934 1.00 0.00 H new ATOM 0 HA GLN D 3 -22.519 13.082 -9.967 1.00 0.00 H new ATOM 0 HB2 GLN D 3 -23.079 13.596 -12.551 1.00 0.00 H new ATOM 0 HB3 GLN D 3 -21.897 12.331 -12.825 1.00 0.00 H new ATOM 0 HG2 GLN D 3 -23.178 10.694 -11.664 1.00 0.00 H new ATOM 0 HG3 GLN D 3 -24.086 11.895 -10.767 1.00 0.00 H new ATOM 0 HE21 GLN D 3 -23.986 10.012 -13.717 1.00 0.00 H new ATOM 0 HE22 GLN D 3 -25.439 10.700 -14.449 1.00 0.00 H new ATOM 52 N ARG D 4 -20.189 12.116 -9.399 1.00 0.00 N ATOM 53 CA ARG D 4 -19.019 11.234 -9.126 1.00 0.00 C ATOM 54 C ARG D 4 -19.502 9.948 -8.456 1.00 0.00 C ATOM 55 O ARG D 4 -20.077 9.973 -7.386 1.00 0.00 O ATOM 56 CB ARG D 4 -18.039 11.957 -8.201 1.00 0.00 C ATOM 57 CG ARG D 4 -17.847 13.394 -8.689 1.00 0.00 C ATOM 58 CD ARG D 4 -17.183 13.379 -10.067 1.00 0.00 C ATOM 59 NE ARG D 4 -16.952 14.777 -10.524 1.00 0.00 N ATOM 60 CZ ARG D 4 -15.771 15.318 -10.395 1.00 0.00 C ATOM 61 NH1 ARG D 4 -15.345 15.675 -9.215 1.00 0.00 N ATOM 62 NH2 ARG D 4 -15.017 15.500 -11.446 1.00 0.00 N ATOM 0 H ARG D 4 -20.574 12.591 -8.583 1.00 0.00 H new ATOM 0 HA ARG D 4 -18.518 10.991 -10.063 1.00 0.00 H new ATOM 0 HB2 ARG D 4 -18.418 11.956 -7.179 1.00 0.00 H new ATOM 0 HB3 ARG D 4 -17.082 11.435 -8.187 1.00 0.00 H new ATOM 0 HG2 ARG D 4 -18.809 13.903 -8.743 1.00 0.00 H new ATOM 0 HG3 ARG D 4 -17.231 13.950 -7.982 1.00 0.00 H new ATOM 0 HD2 ARG D 4 -16.237 12.840 -10.020 1.00 0.00 H new ATOM 0 HD3 ARG D 4 -17.816 12.852 -10.781 1.00 0.00 H new ATOM 0 HE ARG D 4 -17.716 15.312 -10.938 1.00 0.00 H new ATOM 0 HH11 ARG D 4 -15.934 15.531 -8.395 1.00 0.00 H new ATOM 0 HH12 ARG D 4 -14.422 16.098 -9.112 1.00 0.00 H new ATOM 0 HH21 ARG D 4 -15.351 15.219 -12.368 1.00 0.00 H new ATOM 0 HH22 ARG D 4 -14.094 15.923 -11.345 1.00 0.00 H new ATOM 76 N ILE D 5 -19.279 8.822 -9.076 1.00 0.00 N ATOM 77 CA ILE D 5 -19.732 7.538 -8.470 1.00 0.00 C ATOM 78 C ILE D 5 -18.708 6.451 -8.785 1.00 0.00 C ATOM 79 O ILE D 5 -18.052 6.485 -9.806 1.00 0.00 O ATOM 80 CB ILE D 5 -21.094 7.123 -9.048 1.00 0.00 C ATOM 81 CG1 ILE D 5 -21.706 8.274 -9.859 1.00 0.00 C ATOM 82 CG2 ILE D 5 -22.038 6.751 -7.902 1.00 0.00 C ATOM 83 CD1 ILE D 5 -22.209 9.364 -8.909 1.00 0.00 C ATOM 0 H ILE D 5 -18.804 8.735 -9.974 1.00 0.00 H new ATOM 0 HA ILE D 5 -19.828 7.670 -7.392 1.00 0.00 H new ATOM 0 HB ILE D 5 -20.952 6.266 -9.706 1.00 0.00 H new ATOM 0 HG12 ILE D 5 -20.962 8.687 -10.541 1.00 0.00 H new ATOM 0 HG13 ILE D 5 -22.528 7.903 -10.471 1.00 0.00 H new ATOM 0 HG21 ILE D 5 -23.005 6.456 -8.309 1.00 0.00 H new ATOM 0 HG22 ILE D 5 -21.614 5.921 -7.336 1.00 0.00 H new ATOM 0 HG23 ILE D 5 -22.168 7.610 -7.244 1.00 0.00 H new ATOM 0 HD11 ILE D 5 -22.643 10.179 -9.488 1.00 0.00 H new ATOM 0 HD12 ILE D 5 -22.967 8.947 -8.245 1.00 0.00 H new ATOM 0 HD13 ILE D 5 -21.376 9.743 -8.316 1.00 0.00 H new ATOM 95 N THR D 6 -18.571 5.482 -7.925 1.00 0.00 N ATOM 96 CA THR D 6 -17.592 4.395 -8.194 1.00 0.00 C ATOM 97 C THR D 6 -18.168 3.464 -9.262 1.00 0.00 C ATOM 98 O THR D 6 -19.367 3.364 -9.431 1.00 0.00 O ATOM 99 CB THR D 6 -17.331 3.606 -6.908 1.00 0.00 C ATOM 100 OG1 THR D 6 -17.333 4.496 -5.800 1.00 0.00 O ATOM 101 CG2 THR D 6 -15.973 2.909 -7.004 1.00 0.00 C ATOM 0 H THR D 6 -19.092 5.396 -7.052 1.00 0.00 H new ATOM 0 HA THR D 6 -16.653 4.822 -8.544 1.00 0.00 H new ATOM 0 HB THR D 6 -18.112 2.858 -6.774 1.00 0.00 H new ATOM 0 HG1 THR D 6 -17.168 3.992 -4.976 1.00 0.00 H new ATOM 0 HG21 THR D 6 -15.787 2.347 -6.089 1.00 0.00 H new ATOM 0 HG22 THR D 6 -15.973 2.227 -7.854 1.00 0.00 H new ATOM 0 HG23 THR D 6 -15.190 3.655 -7.137 1.00 0.00 H new ATOM 109 N LEU D 7 -17.324 2.783 -9.984 1.00 0.00 N ATOM 110 CA LEU D 7 -17.818 1.861 -11.043 1.00 0.00 C ATOM 111 C LEU D 7 -18.764 0.823 -10.427 1.00 0.00 C ATOM 112 O LEU D 7 -19.482 0.138 -11.124 1.00 0.00 O ATOM 113 CB LEU D 7 -16.624 1.151 -11.687 1.00 0.00 C ATOM 114 CG LEU D 7 -17.118 0.054 -12.631 1.00 0.00 C ATOM 115 CD1 LEU D 7 -17.857 0.685 -13.812 1.00 0.00 C ATOM 116 CD2 LEU D 7 -15.917 -0.740 -13.150 1.00 0.00 C ATOM 0 H LEU D 7 -16.310 2.825 -9.886 1.00 0.00 H new ATOM 0 HA LEU D 7 -18.358 2.430 -11.799 1.00 0.00 H new ATOM 0 HB2 LEU D 7 -16.016 1.869 -12.237 1.00 0.00 H new ATOM 0 HB3 LEU D 7 -15.987 0.719 -10.915 1.00 0.00 H new ATOM 0 HG LEU D 7 -17.796 -0.610 -12.095 1.00 0.00 H new ATOM 0 HD11 LEU D 7 -18.208 -0.099 -14.483 1.00 0.00 H new ATOM 0 HD12 LEU D 7 -18.710 1.256 -13.445 1.00 0.00 H new ATOM 0 HD13 LEU D 7 -17.181 1.348 -14.352 1.00 0.00 H new ATOM 0 HD21 LEU D 7 -16.263 -1.524 -13.824 1.00 0.00 H new ATOM 0 HD22 LEU D 7 -15.243 -0.072 -13.686 1.00 0.00 H new ATOM 0 HD23 LEU D 7 -15.388 -1.191 -12.310 1.00 0.00 H new ATOM 128 N LYS D 8 -18.769 0.696 -9.127 1.00 0.00 N ATOM 129 CA LYS D 8 -19.665 -0.306 -8.481 1.00 0.00 C ATOM 130 C LYS D 8 -21.022 0.329 -8.152 1.00 0.00 C ATOM 131 O LYS D 8 -22.049 -0.320 -8.213 1.00 0.00 O ATOM 132 CB LYS D 8 -19.007 -0.815 -7.193 1.00 0.00 C ATOM 133 CG LYS D 8 -19.195 0.206 -6.065 1.00 0.00 C ATOM 134 CD LYS D 8 -18.090 0.027 -5.022 1.00 0.00 C ATOM 135 CE LYS D 8 -18.711 -0.380 -3.684 1.00 0.00 C ATOM 136 NZ LYS D 8 -18.053 0.379 -2.582 1.00 0.00 N ATOM 0 H LYS D 8 -18.193 1.241 -8.486 1.00 0.00 H new ATOM 0 HA LYS D 8 -19.825 -1.138 -9.167 1.00 0.00 H new ATOM 0 HB2 LYS D 8 -19.445 -1.771 -6.905 1.00 0.00 H new ATOM 0 HB3 LYS D 8 -17.944 -0.989 -7.363 1.00 0.00 H new ATOM 0 HG2 LYS D 8 -19.168 1.218 -6.469 1.00 0.00 H new ATOM 0 HG3 LYS D 8 -20.172 0.074 -5.601 1.00 0.00 H new ATOM 0 HD2 LYS D 8 -17.383 -0.734 -5.353 1.00 0.00 H new ATOM 0 HD3 LYS D 8 -17.530 0.955 -4.908 1.00 0.00 H new ATOM 0 HE2 LYS D 8 -19.782 -0.178 -3.691 1.00 0.00 H new ATOM 0 HE3 LYS D 8 -18.590 -1.452 -3.525 1.00 0.00 H new ATOM 0 HZ1 LYS D 8 -18.474 0.104 -1.672 1.00 0.00 H new ATOM 0 HZ2 LYS D 8 -17.035 0.165 -2.572 1.00 0.00 H new ATOM 0 HZ3 LYS D 8 -18.190 1.399 -2.733 1.00 0.00 H new ATOM 150 N ASP D 9 -21.037 1.582 -7.794 1.00 0.00 N ATOM 151 CA ASP D 9 -22.330 2.242 -7.448 1.00 0.00 C ATOM 152 C ASP D 9 -23.077 2.635 -8.723 1.00 0.00 C ATOM 153 O ASP D 9 -24.291 2.673 -8.753 1.00 0.00 O ATOM 154 CB ASP D 9 -22.055 3.496 -6.615 1.00 0.00 C ATOM 155 CG ASP D 9 -22.029 3.125 -5.131 1.00 0.00 C ATOM 156 OD1 ASP D 9 -22.328 1.983 -4.820 1.00 0.00 O ATOM 157 OD2 ASP D 9 -21.712 3.988 -4.330 1.00 0.00 O ATOM 0 H ASP D 9 -20.212 2.178 -7.726 1.00 0.00 H new ATOM 0 HA ASP D 9 -22.942 1.545 -6.875 1.00 0.00 H new ATOM 0 HB2 ASP D 9 -21.103 3.938 -6.907 1.00 0.00 H new ATOM 0 HB3 ASP D 9 -22.825 4.245 -6.800 1.00 0.00 H new ATOM 162 N TYR D 10 -22.368 2.930 -9.775 1.00 0.00 N ATOM 163 CA TYR D 10 -23.046 3.323 -11.042 1.00 0.00 C ATOM 164 C TYR D 10 -23.524 2.070 -11.774 1.00 0.00 C ATOM 165 O TYR D 10 -24.562 2.062 -12.403 1.00 0.00 O ATOM 166 CB TYR D 10 -22.061 4.091 -11.926 1.00 0.00 C ATOM 167 CG TYR D 10 -22.643 4.258 -13.309 1.00 0.00 C ATOM 168 CD1 TYR D 10 -23.873 4.906 -13.480 1.00 0.00 C ATOM 169 CD2 TYR D 10 -21.950 3.767 -14.422 1.00 0.00 C ATOM 170 CE1 TYR D 10 -24.408 5.062 -14.763 1.00 0.00 C ATOM 171 CE2 TYR D 10 -22.486 3.923 -15.705 1.00 0.00 C ATOM 172 CZ TYR D 10 -23.715 4.570 -15.876 1.00 0.00 C ATOM 173 OH TYR D 10 -24.245 4.724 -17.141 1.00 0.00 O ATOM 0 H TYR D 10 -21.349 2.916 -9.813 1.00 0.00 H new ATOM 0 HA TYR D 10 -23.903 3.958 -10.817 1.00 0.00 H new ATOM 0 HB2 TYR D 10 -21.850 5.067 -11.489 1.00 0.00 H new ATOM 0 HB3 TYR D 10 -21.113 3.555 -11.982 1.00 0.00 H new ATOM 0 HD1 TYR D 10 -24.408 5.285 -12.622 1.00 0.00 H new ATOM 0 HD2 TYR D 10 -21.001 3.268 -14.290 1.00 0.00 H new ATOM 0 HE1 TYR D 10 -25.356 5.562 -14.895 1.00 0.00 H new ATOM 0 HE2 TYR D 10 -21.951 3.544 -16.563 1.00 0.00 H new ATOM 0 HH TYR D 10 -23.638 4.328 -17.800 1.00 0.00 H new ATOM 183 N ALA D 11 -22.772 1.010 -11.697 1.00 0.00 N ATOM 184 CA ALA D 11 -23.178 -0.245 -12.390 1.00 0.00 C ATOM 185 C ALA D 11 -24.234 -0.975 -11.558 1.00 0.00 C ATOM 186 O ALA D 11 -25.012 -1.756 -12.072 1.00 0.00 O ATOM 187 CB ALA D 11 -21.954 -1.145 -12.559 1.00 0.00 C ATOM 0 H ALA D 11 -21.892 0.957 -11.184 1.00 0.00 H new ATOM 0 HA ALA D 11 -23.595 -0.002 -13.367 1.00 0.00 H new ATOM 0 HB1 ALA D 11 -22.246 -2.065 -13.066 1.00 0.00 H new ATOM 0 HB2 ALA D 11 -21.201 -0.627 -13.153 1.00 0.00 H new ATOM 0 HB3 ALA D 11 -21.541 -1.386 -11.579 1.00 0.00 H new ATOM 193 N MET D 12 -24.267 -0.737 -10.275 1.00 0.00 N ATOM 194 CA MET D 12 -25.269 -1.430 -9.417 1.00 0.00 C ATOM 195 C MET D 12 -26.558 -0.609 -9.341 1.00 0.00 C ATOM 196 O MET D 12 -27.645 -1.148 -9.284 1.00 0.00 O ATOM 197 CB MET D 12 -24.696 -1.603 -8.008 1.00 0.00 C ATOM 198 CG MET D 12 -23.609 -2.679 -8.028 1.00 0.00 C ATOM 199 SD MET D 12 -24.271 -4.216 -7.338 1.00 0.00 S ATOM 200 CE MET D 12 -22.771 -4.739 -6.472 1.00 0.00 C ATOM 0 H MET D 12 -23.645 -0.094 -9.785 1.00 0.00 H new ATOM 0 HA MET D 12 -25.493 -2.405 -9.850 1.00 0.00 H new ATOM 0 HB2 MET D 12 -24.282 -0.659 -7.654 1.00 0.00 H new ATOM 0 HB3 MET D 12 -25.488 -1.884 -7.314 1.00 0.00 H new ATOM 0 HG2 MET D 12 -23.265 -2.845 -9.049 1.00 0.00 H new ATOM 0 HG3 MET D 12 -22.746 -2.350 -7.450 1.00 0.00 H new ATOM 0 HE1 MET D 12 -22.955 -5.686 -5.965 1.00 0.00 H new ATOM 0 HE2 MET D 12 -21.961 -4.864 -7.190 1.00 0.00 H new ATOM 0 HE3 MET D 12 -22.492 -3.983 -5.738 1.00 0.00 H new ATOM 210 N ARG D 13 -26.448 0.689 -9.325 1.00 0.00 N ATOM 211 CA ARG D 13 -27.671 1.537 -9.236 1.00 0.00 C ATOM 212 C ARG D 13 -28.184 1.876 -10.639 1.00 0.00 C ATOM 213 O ARG D 13 -29.335 2.221 -10.818 1.00 0.00 O ATOM 214 CB ARG D 13 -27.339 2.827 -8.486 1.00 0.00 C ATOM 215 CG ARG D 13 -27.012 2.497 -7.028 1.00 0.00 C ATOM 216 CD ARG D 13 -28.149 2.980 -6.126 1.00 0.00 C ATOM 217 NE ARG D 13 -29.107 1.862 -5.890 1.00 0.00 N ATOM 218 CZ ARG D 13 -29.431 1.527 -4.672 1.00 0.00 C ATOM 219 NH1 ARG D 13 -30.062 2.375 -3.906 1.00 0.00 N ATOM 220 NH2 ARG D 13 -29.124 0.342 -4.218 1.00 0.00 N ATOM 0 H ARG D 13 -25.566 1.200 -9.370 1.00 0.00 H new ATOM 0 HA ARG D 13 -28.446 0.989 -8.701 1.00 0.00 H new ATOM 0 HB2 ARG D 13 -26.492 3.326 -8.956 1.00 0.00 H new ATOM 0 HB3 ARG D 13 -28.182 3.516 -8.534 1.00 0.00 H new ATOM 0 HG2 ARG D 13 -26.872 1.422 -6.910 1.00 0.00 H new ATOM 0 HG3 ARG D 13 -26.076 2.974 -6.738 1.00 0.00 H new ATOM 0 HD2 ARG D 13 -27.748 3.336 -5.177 1.00 0.00 H new ATOM 0 HD3 ARG D 13 -28.663 3.821 -6.590 1.00 0.00 H new ATOM 0 HE ARG D 13 -29.509 1.359 -6.681 1.00 0.00 H new ATOM 0 HH11 ARG D 13 -30.302 3.301 -4.260 1.00 0.00 H new ATOM 0 HH12 ARG D 13 -30.315 2.112 -2.954 1.00 0.00 H new ATOM 0 HH21 ARG D 13 -28.631 -0.321 -4.816 1.00 0.00 H new ATOM 0 HH22 ARG D 13 -29.377 0.079 -3.265 1.00 0.00 H new ATOM 234 N PHE D 14 -27.347 1.785 -11.636 1.00 0.00 N ATOM 235 CA PHE D 14 -27.807 2.110 -13.017 1.00 0.00 C ATOM 236 C PHE D 14 -27.699 0.868 -13.904 1.00 0.00 C ATOM 237 O PHE D 14 -28.115 0.873 -15.045 1.00 0.00 O ATOM 238 CB PHE D 14 -26.936 3.227 -13.597 1.00 0.00 C ATOM 239 CG PHE D 14 -26.885 4.383 -12.625 1.00 0.00 C ATOM 240 CD1 PHE D 14 -26.237 4.232 -11.394 1.00 0.00 C ATOM 241 CD2 PHE D 14 -27.487 5.602 -12.957 1.00 0.00 C ATOM 242 CE1 PHE D 14 -26.191 5.304 -10.493 1.00 0.00 C ATOM 243 CE2 PHE D 14 -27.440 6.673 -12.057 1.00 0.00 C ATOM 244 CZ PHE D 14 -26.792 6.524 -10.825 1.00 0.00 C ATOM 0 H PHE D 14 -26.370 1.502 -11.556 1.00 0.00 H new ATOM 0 HA PHE D 14 -28.846 2.439 -12.981 1.00 0.00 H new ATOM 0 HB2 PHE D 14 -25.930 2.855 -13.789 1.00 0.00 H new ATOM 0 HB3 PHE D 14 -27.341 3.559 -14.553 1.00 0.00 H new ATOM 0 HD1 PHE D 14 -25.773 3.291 -11.139 1.00 0.00 H new ATOM 0 HD2 PHE D 14 -27.988 5.716 -13.907 1.00 0.00 H new ATOM 0 HE1 PHE D 14 -25.692 5.189 -9.542 1.00 0.00 H new ATOM 0 HE2 PHE D 14 -27.904 7.614 -12.313 1.00 0.00 H new ATOM 0 HZ PHE D 14 -26.756 7.350 -10.131 1.00 0.00 H new ATOM 254 N GLY D 15 -27.148 -0.197 -13.392 1.00 0.00 N ATOM 255 CA GLY D 15 -27.021 -1.435 -14.213 1.00 0.00 C ATOM 256 C GLY D 15 -25.598 -1.540 -14.767 1.00 0.00 C ATOM 257 O GLY D 15 -25.052 -0.587 -15.288 1.00 0.00 O ATOM 0 H GLY D 15 -26.781 -0.265 -12.443 1.00 0.00 H new ATOM 0 HA2 GLY D 15 -27.251 -2.311 -13.607 1.00 0.00 H new ATOM 0 HA3 GLY D 15 -27.740 -1.416 -15.032 1.00 0.00 H new ATOM 261 N GLN D 16 -24.993 -2.691 -14.661 1.00 0.00 N ATOM 262 CA GLN D 16 -23.607 -2.855 -15.182 1.00 0.00 C ATOM 263 C GLN D 16 -23.646 -2.997 -16.704 1.00 0.00 C ATOM 264 O GLN D 16 -22.746 -2.571 -17.400 1.00 0.00 O ATOM 265 CB GLN D 16 -22.971 -4.108 -14.573 1.00 0.00 C ATOM 266 CG GLN D 16 -23.052 -4.037 -13.047 1.00 0.00 C ATOM 267 CD GLN D 16 -23.439 -5.407 -12.488 1.00 0.00 C ATOM 268 OE1 GLN D 16 -22.606 -6.121 -11.965 1.00 0.00 O ATOM 269 NE2 GLN D 16 -24.678 -5.808 -12.575 1.00 0.00 N ATOM 0 H GLN D 16 -25.399 -3.525 -14.236 1.00 0.00 H new ATOM 0 HA GLN D 16 -23.016 -1.980 -14.911 1.00 0.00 H new ATOM 0 HB2 GLN D 16 -23.484 -5.000 -14.933 1.00 0.00 H new ATOM 0 HB3 GLN D 16 -21.931 -4.190 -14.888 1.00 0.00 H new ATOM 0 HG2 GLN D 16 -22.092 -3.724 -12.636 1.00 0.00 H new ATOM 0 HG3 GLN D 16 -23.787 -3.290 -12.746 1.00 0.00 H new ATOM 0 HE21 GLN D 16 -25.378 -5.210 -13.014 1.00 0.00 H new ATOM 0 HE22 GLN D 16 -24.946 -6.720 -12.204 1.00 0.00 H new ATOM 278 N THR D 17 -24.681 -3.595 -17.226 1.00 0.00 N ATOM 279 CA THR D 17 -24.775 -3.766 -18.702 1.00 0.00 C ATOM 280 C THR D 17 -24.768 -2.395 -19.380 1.00 0.00 C ATOM 281 O THR D 17 -24.257 -2.236 -20.471 1.00 0.00 O ATOM 282 CB THR D 17 -26.072 -4.501 -19.050 1.00 0.00 C ATOM 283 OG1 THR D 17 -26.396 -4.262 -20.412 1.00 0.00 O ATOM 284 CG2 THR D 17 -27.204 -3.994 -18.157 1.00 0.00 C ATOM 0 H THR D 17 -25.465 -3.972 -16.694 1.00 0.00 H new ATOM 0 HA THR D 17 -23.922 -4.347 -19.053 1.00 0.00 H new ATOM 0 HB THR D 17 -25.939 -5.571 -18.889 1.00 0.00 H new ATOM 0 HG1 THR D 17 -27.225 -4.733 -20.638 1.00 0.00 H new ATOM 0 HG21 THR D 17 -28.127 -4.518 -18.406 1.00 0.00 H new ATOM 0 HG22 THR D 17 -26.953 -4.177 -17.112 1.00 0.00 H new ATOM 0 HG23 THR D 17 -27.341 -2.924 -18.315 1.00 0.00 H new ATOM 292 N LYS D 18 -25.333 -1.403 -18.747 1.00 0.00 N ATOM 293 CA LYS D 18 -25.355 -0.047 -19.364 1.00 0.00 C ATOM 294 C LYS D 18 -24.046 0.680 -19.049 1.00 0.00 C ATOM 295 O LYS D 18 -23.630 1.566 -19.769 1.00 0.00 O ATOM 296 CB LYS D 18 -26.539 0.750 -18.811 1.00 0.00 C ATOM 297 CG LYS D 18 -26.320 1.047 -17.326 1.00 0.00 C ATOM 298 CD LYS D 18 -26.680 2.506 -17.040 1.00 0.00 C ATOM 299 CE LYS D 18 -28.201 2.670 -17.068 1.00 0.00 C ATOM 300 NZ LYS D 18 -28.590 3.494 -18.248 1.00 0.00 N ATOM 0 H LYS D 18 -25.779 -1.473 -17.832 1.00 0.00 H new ATOM 0 HA LYS D 18 -25.462 -0.141 -20.445 1.00 0.00 H new ATOM 0 HB2 LYS D 18 -26.651 1.682 -19.364 1.00 0.00 H new ATOM 0 HB3 LYS D 18 -27.462 0.187 -18.946 1.00 0.00 H new ATOM 0 HG2 LYS D 18 -26.934 0.384 -16.717 1.00 0.00 H new ATOM 0 HG3 LYS D 18 -25.281 0.858 -17.055 1.00 0.00 H new ATOM 0 HD2 LYS D 18 -26.289 2.804 -16.067 1.00 0.00 H new ATOM 0 HD3 LYS D 18 -26.219 3.158 -17.782 1.00 0.00 H new ATOM 0 HE2 LYS D 18 -28.682 1.693 -17.119 1.00 0.00 H new ATOM 0 HE3 LYS D 18 -28.543 3.147 -16.149 1.00 0.00 H new ATOM 0 HZ1 LYS D 18 -29.610 3.691 -18.212 1.00 0.00 H new ATOM 0 HZ2 LYS D 18 -28.063 4.391 -18.234 1.00 0.00 H new ATOM 0 HZ3 LYS D 18 -28.368 2.976 -19.122 1.00 0.00 H new ATOM 314 N THR D 19 -23.385 0.310 -17.985 1.00 0.00 N ATOM 315 CA THR D 19 -22.099 0.983 -17.642 1.00 0.00 C ATOM 316 C THR D 19 -21.030 0.541 -18.642 1.00 0.00 C ATOM 317 O THR D 19 -20.156 1.301 -19.010 1.00 0.00 O ATOM 318 CB THR D 19 -21.670 0.593 -16.225 1.00 0.00 C ATOM 319 OG1 THR D 19 -22.673 0.993 -15.301 1.00 0.00 O ATOM 320 CG2 THR D 19 -20.349 1.286 -15.878 1.00 0.00 C ATOM 0 H THR D 19 -23.678 -0.425 -17.342 1.00 0.00 H new ATOM 0 HA THR D 19 -22.226 2.065 -17.687 1.00 0.00 H new ATOM 0 HB THR D 19 -21.535 -0.487 -16.172 1.00 0.00 H new ATOM 0 HG1 THR D 19 -22.614 1.960 -15.152 1.00 0.00 H new ATOM 0 HG21 THR D 19 -20.046 1.007 -14.869 1.00 0.00 H new ATOM 0 HG22 THR D 19 -19.580 0.978 -16.586 1.00 0.00 H new ATOM 0 HG23 THR D 19 -20.480 2.367 -15.932 1.00 0.00 H new ATOM 328 N ALA D 20 -21.099 -0.683 -19.090 1.00 0.00 N ATOM 329 CA ALA D 20 -20.096 -1.177 -20.073 1.00 0.00 C ATOM 330 C ALA D 20 -20.491 -0.700 -21.471 1.00 0.00 C ATOM 331 O ALA D 20 -19.656 -0.510 -22.332 1.00 0.00 O ATOM 332 CB ALA D 20 -20.063 -2.707 -20.047 1.00 0.00 C ATOM 0 H ALA D 20 -21.809 -1.363 -18.816 1.00 0.00 H new ATOM 0 HA ALA D 20 -19.109 -0.791 -19.816 1.00 0.00 H new ATOM 0 HB1 ALA D 20 -19.328 -3.067 -20.767 1.00 0.00 H new ATOM 0 HB2 ALA D 20 -19.790 -3.048 -19.048 1.00 0.00 H new ATOM 0 HB3 ALA D 20 -21.047 -3.097 -20.307 1.00 0.00 H new ATOM 338 N LYS D 21 -21.761 -0.499 -21.700 1.00 0.00 N ATOM 339 CA LYS D 21 -22.211 -0.028 -23.038 1.00 0.00 C ATOM 340 C LYS D 21 -21.855 1.451 -23.192 1.00 0.00 C ATOM 341 O LYS D 21 -21.604 1.930 -24.281 1.00 0.00 O ATOM 342 CB LYS D 21 -23.727 -0.203 -23.158 1.00 0.00 C ATOM 343 CG LYS D 21 -24.096 -0.509 -24.611 1.00 0.00 C ATOM 344 CD LYS D 21 -25.612 -0.396 -24.787 1.00 0.00 C ATOM 345 CE LYS D 21 -25.991 1.066 -25.025 1.00 0.00 C ATOM 346 NZ LYS D 21 -25.727 1.423 -26.446 1.00 0.00 N ATOM 0 H LYS D 21 -22.505 -0.641 -21.017 1.00 0.00 H new ATOM 0 HA LYS D 21 -21.718 -0.609 -23.818 1.00 0.00 H new ATOM 0 HB2 LYS D 21 -24.062 -1.012 -22.509 1.00 0.00 H new ATOM 0 HB3 LYS D 21 -24.235 0.703 -22.826 1.00 0.00 H new ATOM 0 HG2 LYS D 21 -23.589 0.186 -25.280 1.00 0.00 H new ATOM 0 HG3 LYS D 21 -23.762 -1.511 -24.879 1.00 0.00 H new ATOM 0 HD2 LYS D 21 -25.938 -1.009 -25.628 1.00 0.00 H new ATOM 0 HD3 LYS D 21 -26.121 -0.775 -23.901 1.00 0.00 H new ATOM 0 HE2 LYS D 21 -27.044 1.223 -24.789 1.00 0.00 H new ATOM 0 HE3 LYS D 21 -25.416 1.714 -24.363 1.00 0.00 H new ATOM 0 HZ1 LYS D 21 -26.167 2.340 -26.661 1.00 0.00 H new ATOM 0 HZ2 LYS D 21 -24.701 1.486 -26.603 1.00 0.00 H new ATOM 0 HZ3 LYS D 21 -26.128 0.692 -27.068 1.00 0.00 H new ATOM 360 N ASP D 22 -21.832 2.177 -22.109 1.00 0.00 N ATOM 361 CA ASP D 22 -21.493 3.624 -22.186 1.00 0.00 C ATOM 362 C ASP D 22 -19.973 3.788 -22.252 1.00 0.00 C ATOM 363 O ASP D 22 -19.460 4.648 -22.940 1.00 0.00 O ATOM 364 CB ASP D 22 -22.032 4.342 -20.946 1.00 0.00 C ATOM 365 CG ASP D 22 -23.177 5.272 -21.351 1.00 0.00 C ATOM 366 OD1 ASP D 22 -23.043 5.939 -22.363 1.00 0.00 O ATOM 367 OD2 ASP D 22 -24.168 5.301 -20.641 1.00 0.00 O ATOM 0 H ASP D 22 -22.034 1.829 -21.172 1.00 0.00 H new ATOM 0 HA ASP D 22 -21.944 4.056 -23.079 1.00 0.00 H new ATOM 0 HB2 ASP D 22 -22.383 3.614 -20.215 1.00 0.00 H new ATOM 0 HB3 ASP D 22 -21.236 4.914 -20.470 1.00 0.00 H new ATOM 372 N LEU D 23 -19.252 2.967 -21.542 1.00 0.00 N ATOM 373 CA LEU D 23 -17.765 3.068 -21.562 1.00 0.00 C ATOM 374 C LEU D 23 -17.221 2.305 -22.769 1.00 0.00 C ATOM 375 O LEU D 23 -16.057 2.400 -23.105 1.00 0.00 O ATOM 376 CB LEU D 23 -17.193 2.463 -20.278 1.00 0.00 C ATOM 377 CG LEU D 23 -17.408 3.434 -19.116 1.00 0.00 C ATOM 378 CD1 LEU D 23 -18.070 2.697 -17.950 1.00 0.00 C ATOM 379 CD2 LEU D 23 -16.057 3.997 -18.664 1.00 0.00 C ATOM 0 H LEU D 23 -19.628 2.229 -20.947 1.00 0.00 H new ATOM 0 HA LEU D 23 -17.473 4.116 -21.630 1.00 0.00 H new ATOM 0 HB2 LEU D 23 -17.678 1.511 -20.065 1.00 0.00 H new ATOM 0 HB3 LEU D 23 -16.130 2.258 -20.402 1.00 0.00 H new ATOM 0 HG LEU D 23 -18.052 4.251 -19.441 1.00 0.00 H new ATOM 0 HD11 LEU D 23 -18.223 3.389 -17.122 1.00 0.00 H new ATOM 0 HD12 LEU D 23 -19.032 2.297 -18.271 1.00 0.00 H new ATOM 0 HD13 LEU D 23 -17.427 1.879 -17.625 1.00 0.00 H new ATOM 0 HD21 LEU D 23 -16.210 4.689 -17.836 1.00 0.00 H new ATOM 0 HD22 LEU D 23 -15.412 3.180 -18.340 1.00 0.00 H new ATOM 0 HD23 LEU D 23 -15.586 4.523 -19.494 1.00 0.00 H new ATOM 391 N GLY D 24 -18.053 1.541 -23.422 1.00 0.00 N ATOM 392 CA GLY D 24 -17.583 0.765 -24.604 1.00 0.00 C ATOM 393 C GLY D 24 -17.094 -0.607 -24.143 1.00 0.00 C ATOM 394 O GLY D 24 -17.176 -1.582 -24.863 1.00 0.00 O ATOM 0 H GLY D 24 -19.038 1.421 -23.188 1.00 0.00 H new ATOM 0 HA2 GLY D 24 -18.393 0.652 -25.325 1.00 0.00 H new ATOM 0 HA3 GLY D 24 -16.779 1.300 -25.109 1.00 0.00 H new ATOM 398 N VAL D 25 -16.586 -0.690 -22.945 1.00 0.00 N ATOM 399 CA VAL D 25 -16.093 -1.996 -22.429 1.00 0.00 C ATOM 400 C VAL D 25 -17.215 -3.033 -22.506 1.00 0.00 C ATOM 401 O VAL D 25 -18.258 -2.794 -23.084 1.00 0.00 O ATOM 402 CB VAL D 25 -15.646 -1.833 -20.976 1.00 0.00 C ATOM 403 CG1 VAL D 25 -14.217 -1.289 -20.940 1.00 0.00 C ATOM 404 CG2 VAL D 25 -16.579 -0.852 -20.263 1.00 0.00 C ATOM 0 H VAL D 25 -16.491 0.094 -22.299 1.00 0.00 H new ATOM 0 HA VAL D 25 -15.250 -2.330 -23.033 1.00 0.00 H new ATOM 0 HB VAL D 25 -15.681 -2.800 -20.475 1.00 0.00 H new ATOM 0 HG11 VAL D 25 -13.898 -1.173 -19.904 1.00 0.00 H new ATOM 0 HG12 VAL D 25 -13.550 -1.985 -21.449 1.00 0.00 H new ATOM 0 HG13 VAL D 25 -14.183 -0.321 -21.441 1.00 0.00 H new ATOM 0 HG21 VAL D 25 -16.261 -0.735 -19.227 1.00 0.00 H new ATOM 0 HG22 VAL D 25 -16.543 0.115 -20.765 1.00 0.00 H new ATOM 0 HG23 VAL D 25 -17.599 -1.236 -20.288 1.00 0.00 H new ATOM 414 N TYR D 26 -17.010 -4.185 -21.929 1.00 0.00 N ATOM 415 CA TYR D 26 -18.063 -5.240 -21.972 1.00 0.00 C ATOM 416 C TYR D 26 -18.563 -5.523 -20.554 1.00 0.00 C ATOM 417 O TYR D 26 -18.047 -5.001 -19.586 1.00 0.00 O ATOM 418 CB TYR D 26 -17.494 -6.534 -22.570 1.00 0.00 C ATOM 419 CG TYR D 26 -16.242 -6.239 -23.364 1.00 0.00 C ATOM 420 CD1 TYR D 26 -16.338 -5.677 -24.642 1.00 0.00 C ATOM 421 CD2 TYR D 26 -14.985 -6.528 -22.819 1.00 0.00 C ATOM 422 CE1 TYR D 26 -15.177 -5.405 -25.376 1.00 0.00 C ATOM 423 CE2 TYR D 26 -13.825 -6.256 -23.552 1.00 0.00 C ATOM 424 CZ TYR D 26 -13.921 -5.694 -24.830 1.00 0.00 C ATOM 425 OH TYR D 26 -12.776 -5.426 -25.553 1.00 0.00 O ATOM 0 H TYR D 26 -16.159 -4.442 -21.429 1.00 0.00 H new ATOM 0 HA TYR D 26 -18.886 -4.888 -22.593 1.00 0.00 H new ATOM 0 HB2 TYR D 26 -17.269 -7.243 -21.773 1.00 0.00 H new ATOM 0 HB3 TYR D 26 -18.238 -7.004 -23.213 1.00 0.00 H new ATOM 0 HD1 TYR D 26 -17.307 -5.453 -25.062 1.00 0.00 H new ATOM 0 HD2 TYR D 26 -14.911 -6.961 -21.832 1.00 0.00 H new ATOM 0 HE1 TYR D 26 -15.251 -4.972 -26.363 1.00 0.00 H new ATOM 0 HE2 TYR D 26 -12.856 -6.480 -23.132 1.00 0.00 H new ATOM 0 HH TYR D 26 -11.990 -5.685 -25.029 1.00 0.00 H new ATOM 435 N GLN D 27 -19.563 -6.351 -20.429 1.00 0.00 N ATOM 436 CA GLN D 27 -20.099 -6.675 -19.077 1.00 0.00 C ATOM 437 C GLN D 27 -19.076 -7.516 -18.314 1.00 0.00 C ATOM 438 O GLN D 27 -18.965 -7.434 -17.106 1.00 0.00 O ATOM 439 CB GLN D 27 -21.402 -7.465 -19.217 1.00 0.00 C ATOM 440 CG GLN D 27 -22.577 -6.494 -19.327 1.00 0.00 C ATOM 441 CD GLN D 27 -23.710 -6.959 -18.410 1.00 0.00 C ATOM 442 OE1 GLN D 27 -23.602 -6.878 -17.202 1.00 0.00 O ATOM 443 NE2 GLN D 27 -24.801 -7.448 -18.936 1.00 0.00 N ATOM 0 H GLN D 27 -20.032 -6.818 -21.205 1.00 0.00 H new ATOM 0 HA GLN D 27 -20.292 -5.750 -18.533 1.00 0.00 H new ATOM 0 HB2 GLN D 27 -21.360 -8.103 -20.100 1.00 0.00 H new ATOM 0 HB3 GLN D 27 -21.537 -8.120 -18.356 1.00 0.00 H new ATOM 0 HG2 GLN D 27 -22.259 -5.489 -19.049 1.00 0.00 H new ATOM 0 HG3 GLN D 27 -22.926 -6.444 -20.358 1.00 0.00 H new ATOM 0 HE21 GLN D 27 -24.892 -7.516 -19.950 1.00 0.00 H new ATOM 0 HE22 GLN D 27 -25.562 -7.762 -18.333 1.00 0.00 H new ATOM 452 N SER D 28 -18.327 -8.327 -19.010 1.00 0.00 N ATOM 453 CA SER D 28 -17.313 -9.176 -18.325 1.00 0.00 C ATOM 454 C SER D 28 -16.153 -8.299 -17.852 1.00 0.00 C ATOM 455 O SER D 28 -15.335 -8.713 -17.053 1.00 0.00 O ATOM 456 CB SER D 28 -16.784 -10.228 -19.301 1.00 0.00 C ATOM 457 OG SER D 28 -17.832 -10.629 -20.174 1.00 0.00 O ATOM 0 H SER D 28 -18.374 -8.438 -20.023 1.00 0.00 H new ATOM 0 HA SER D 28 -17.773 -9.670 -17.469 1.00 0.00 H new ATOM 0 HB2 SER D 28 -15.952 -9.821 -19.876 1.00 0.00 H new ATOM 0 HB3 SER D 28 -16.402 -11.089 -18.753 1.00 0.00 H new ATOM 0 HG SER D 28 -17.495 -11.302 -20.802 1.00 0.00 H new ATOM 463 N ALA D 29 -16.078 -7.088 -18.331 1.00 0.00 N ATOM 464 CA ALA D 29 -14.975 -6.186 -17.904 1.00 0.00 C ATOM 465 C ALA D 29 -15.429 -5.412 -16.675 1.00 0.00 C ATOM 466 O ALA D 29 -14.648 -5.087 -15.802 1.00 0.00 O ATOM 467 CB ALA D 29 -14.641 -5.211 -19.035 1.00 0.00 C ATOM 0 H ALA D 29 -16.734 -6.685 -19.000 1.00 0.00 H new ATOM 0 HA ALA D 29 -14.086 -6.770 -17.667 1.00 0.00 H new ATOM 0 HB1 ALA D 29 -13.833 -4.551 -18.720 1.00 0.00 H new ATOM 0 HB2 ALA D 29 -14.330 -5.770 -19.917 1.00 0.00 H new ATOM 0 HB3 ALA D 29 -15.522 -4.616 -19.275 1.00 0.00 H new ATOM 473 N ILE D 30 -16.695 -5.126 -16.598 1.00 0.00 N ATOM 474 CA ILE D 30 -17.220 -4.387 -15.425 1.00 0.00 C ATOM 475 C ILE D 30 -17.384 -5.368 -14.265 1.00 0.00 C ATOM 476 O ILE D 30 -17.285 -5.004 -13.109 1.00 0.00 O ATOM 477 CB ILE D 30 -18.573 -3.776 -15.783 1.00 0.00 C ATOM 478 CG1 ILE D 30 -18.434 -2.955 -17.068 1.00 0.00 C ATOM 479 CG2 ILE D 30 -19.033 -2.871 -14.645 1.00 0.00 C ATOM 480 CD1 ILE D 30 -17.630 -1.685 -16.780 1.00 0.00 C ATOM 0 H ILE D 30 -17.391 -5.374 -17.301 1.00 0.00 H new ATOM 0 HA ILE D 30 -16.533 -3.591 -15.138 1.00 0.00 H new ATOM 0 HB ILE D 30 -19.306 -4.568 -15.937 1.00 0.00 H new ATOM 0 HG12 ILE D 30 -17.937 -3.546 -17.837 1.00 0.00 H new ATOM 0 HG13 ILE D 30 -19.420 -2.694 -17.454 1.00 0.00 H new ATOM 0 HG21 ILE D 30 -19.999 -2.433 -14.896 1.00 0.00 H new ATOM 0 HG22 ILE D 30 -19.127 -3.456 -13.730 1.00 0.00 H new ATOM 0 HG23 ILE D 30 -18.302 -2.077 -14.494 1.00 0.00 H new ATOM 0 HD11 ILE D 30 -17.532 -1.101 -17.695 1.00 0.00 H new ATOM 0 HD12 ILE D 30 -18.145 -1.092 -16.025 1.00 0.00 H new ATOM 0 HD13 ILE D 30 -16.640 -1.956 -16.415 1.00 0.00 H new ATOM 492 N ASN D 31 -17.623 -6.615 -14.569 1.00 0.00 N ATOM 493 CA ASN D 31 -17.784 -7.627 -13.490 1.00 0.00 C ATOM 494 C ASN D 31 -16.403 -8.028 -12.969 1.00 0.00 C ATOM 495 O ASN D 31 -16.191 -8.153 -11.779 1.00 0.00 O ATOM 496 CB ASN D 31 -18.503 -8.860 -14.041 1.00 0.00 C ATOM 497 CG ASN D 31 -18.793 -9.833 -12.897 1.00 0.00 C ATOM 498 OD1 ASN D 31 -19.146 -9.422 -11.810 1.00 0.00 O ATOM 499 ND2 ASN D 31 -18.659 -11.115 -13.096 1.00 0.00 N ATOM 0 H ASN D 31 -17.713 -6.975 -15.519 1.00 0.00 H new ATOM 0 HA ASN D 31 -18.375 -7.204 -12.677 1.00 0.00 H new ATOM 0 HB2 ASN D 31 -19.433 -8.565 -14.527 1.00 0.00 H new ATOM 0 HB3 ASN D 31 -17.887 -9.345 -14.798 1.00 0.00 H new ATOM 0 HD21 ASN D 31 -18.851 -11.771 -12.339 1.00 0.00 H new ATOM 0 HD22 ASN D 31 -18.363 -11.461 -14.009 1.00 0.00 H new ATOM 506 N LYS D 32 -15.455 -8.228 -13.849 1.00 0.00 N ATOM 507 CA LYS D 32 -14.091 -8.612 -13.392 1.00 0.00 C ATOM 508 C LYS D 32 -13.432 -7.411 -12.713 1.00 0.00 C ATOM 509 O LYS D 32 -12.579 -7.559 -11.861 1.00 0.00 O ATOM 510 CB LYS D 32 -13.251 -9.052 -14.590 1.00 0.00 C ATOM 511 CG LYS D 32 -12.986 -7.847 -15.487 1.00 0.00 C ATOM 512 CD LYS D 32 -12.468 -8.327 -16.843 1.00 0.00 C ATOM 513 CE LYS D 32 -11.195 -9.150 -16.639 1.00 0.00 C ATOM 514 NZ LYS D 32 -10.042 -8.447 -17.271 1.00 0.00 N ATOM 0 H LYS D 32 -15.568 -8.142 -14.859 1.00 0.00 H new ATOM 0 HA LYS D 32 -14.162 -9.438 -12.684 1.00 0.00 H new ATOM 0 HB2 LYS D 32 -12.309 -9.482 -14.250 1.00 0.00 H new ATOM 0 HB3 LYS D 32 -13.772 -9.829 -15.149 1.00 0.00 H new ATOM 0 HG2 LYS D 32 -13.901 -7.270 -15.619 1.00 0.00 H new ATOM 0 HG3 LYS D 32 -12.256 -7.186 -15.020 1.00 0.00 H new ATOM 0 HD2 LYS D 32 -13.227 -8.929 -17.342 1.00 0.00 H new ATOM 0 HD3 LYS D 32 -12.263 -7.473 -17.489 1.00 0.00 H new ATOM 0 HE2 LYS D 32 -11.008 -9.293 -15.575 1.00 0.00 H new ATOM 0 HE3 LYS D 32 -11.315 -10.141 -17.078 1.00 0.00 H new ATOM 0 HZ1 LYS D 32 -9.176 -9.006 -17.133 1.00 0.00 H new ATOM 0 HZ2 LYS D 32 -10.221 -8.332 -18.289 1.00 0.00 H new ATOM 0 HZ3 LYS D 32 -9.923 -7.511 -16.833 1.00 0.00 H new ATOM 528 N ALA D 33 -13.827 -6.222 -13.077 1.00 0.00 N ATOM 529 CA ALA D 33 -13.230 -5.013 -12.443 1.00 0.00 C ATOM 530 C ALA D 33 -13.745 -4.899 -11.011 1.00 0.00 C ATOM 531 O ALA D 33 -13.007 -4.605 -10.092 1.00 0.00 O ATOM 532 CB ALA D 33 -13.631 -3.768 -13.235 1.00 0.00 C ATOM 0 H ALA D 33 -14.537 -6.036 -13.785 1.00 0.00 H new ATOM 0 HA ALA D 33 -12.143 -5.097 -12.437 1.00 0.00 H new ATOM 0 HB1 ALA D 33 -13.194 -2.884 -12.770 1.00 0.00 H new ATOM 0 HB2 ALA D 33 -13.269 -3.856 -14.259 1.00 0.00 H new ATOM 0 HB3 ALA D 33 -14.717 -3.675 -13.241 1.00 0.00 H new ATOM 538 N ILE D 34 -15.011 -5.140 -10.814 1.00 0.00 N ATOM 539 CA ILE D 34 -15.580 -5.060 -9.442 1.00 0.00 C ATOM 540 C ILE D 34 -15.119 -6.278 -8.643 1.00 0.00 C ATOM 541 O ILE D 34 -15.015 -6.243 -7.434 1.00 0.00 O ATOM 542 CB ILE D 34 -17.107 -5.051 -9.524 1.00 0.00 C ATOM 543 CG1 ILE D 34 -17.573 -3.714 -10.105 1.00 0.00 C ATOM 544 CG2 ILE D 34 -17.698 -5.233 -8.125 1.00 0.00 C ATOM 545 CD1 ILE D 34 -19.099 -3.624 -10.022 1.00 0.00 C ATOM 0 H ILE D 34 -15.676 -5.389 -11.546 1.00 0.00 H new ATOM 0 HA ILE D 34 -15.240 -4.147 -8.953 1.00 0.00 H new ATOM 0 HB ILE D 34 -17.442 -5.866 -10.165 1.00 0.00 H new ATOM 0 HG12 ILE D 34 -17.119 -2.889 -9.556 1.00 0.00 H new ATOM 0 HG13 ILE D 34 -17.249 -3.623 -11.142 1.00 0.00 H new ATOM 0 HG21 ILE D 34 -18.786 -5.226 -8.186 1.00 0.00 H new ATOM 0 HG22 ILE D 34 -17.364 -6.184 -7.710 1.00 0.00 H new ATOM 0 HG23 ILE D 34 -17.366 -4.419 -7.481 1.00 0.00 H new ATOM 0 HD11 ILE D 34 -19.430 -2.672 -10.436 1.00 0.00 H new ATOM 0 HD12 ILE D 34 -19.543 -4.441 -10.591 1.00 0.00 H new ATOM 0 HD13 ILE D 34 -19.412 -3.695 -8.980 1.00 0.00 H new ATOM 557 N HIS D 35 -14.839 -7.358 -9.319 1.00 0.00 N ATOM 558 CA HIS D 35 -14.381 -8.588 -8.615 1.00 0.00 C ATOM 559 C HIS D 35 -12.967 -8.365 -8.073 1.00 0.00 C ATOM 560 O HIS D 35 -12.514 -9.060 -7.185 1.00 0.00 O ATOM 561 CB HIS D 35 -14.379 -9.761 -9.598 1.00 0.00 C ATOM 562 CG HIS D 35 -15.765 -10.339 -9.688 1.00 0.00 C ATOM 563 ND1 HIS D 35 -16.028 -11.527 -10.350 1.00 0.00 N ATOM 564 CD2 HIS D 35 -16.974 -9.905 -9.201 1.00 0.00 C ATOM 565 CE1 HIS D 35 -17.348 -11.766 -10.245 1.00 0.00 C ATOM 566 NE2 HIS D 35 -17.972 -10.808 -9.554 1.00 0.00 N ATOM 0 H HIS D 35 -14.908 -7.441 -10.333 1.00 0.00 H new ATOM 0 HA HIS D 35 -15.053 -8.811 -7.787 1.00 0.00 H new ATOM 0 HB2 HIS D 35 -14.048 -9.426 -10.581 1.00 0.00 H new ATOM 0 HB3 HIS D 35 -13.675 -10.525 -9.268 1.00 0.00 H new ATOM 0 HD2 HIS D 35 -17.127 -9.001 -8.631 1.00 0.00 H new ATOM 0 HE1 HIS D 35 -17.843 -12.628 -10.668 1.00 0.00 H new ATOM 0 HE2 HIS D 35 -18.966 -10.751 -9.333 1.00 0.00 H new ATOM 574 N ALA D 36 -12.268 -7.395 -8.598 1.00 0.00 N ATOM 575 CA ALA D 36 -10.886 -7.122 -8.110 1.00 0.00 C ATOM 576 C ALA D 36 -10.951 -6.151 -6.931 1.00 0.00 C ATOM 577 O ALA D 36 -10.009 -6.010 -6.177 1.00 0.00 O ATOM 578 CB ALA D 36 -10.060 -6.502 -9.239 1.00 0.00 C ATOM 0 H ALA D 36 -12.594 -6.780 -9.344 1.00 0.00 H new ATOM 0 HA ALA D 36 -10.419 -8.054 -7.791 1.00 0.00 H new ATOM 0 HB1 ALA D 36 -9.049 -6.302 -8.883 1.00 0.00 H new ATOM 0 HB2 ALA D 36 -10.018 -7.193 -10.081 1.00 0.00 H new ATOM 0 HB3 ALA D 36 -10.523 -5.569 -9.559 1.00 0.00 H new ATOM 584 N GLY D 37 -12.058 -5.481 -6.765 1.00 0.00 N ATOM 585 CA GLY D 37 -12.188 -4.521 -5.633 1.00 0.00 C ATOM 586 C GLY D 37 -11.049 -3.501 -5.682 1.00 0.00 C ATOM 587 O GLY D 37 -10.639 -2.968 -4.671 1.00 0.00 O ATOM 0 H GLY D 37 -12.879 -5.557 -7.365 1.00 0.00 H new ATOM 0 HA2 GLY D 37 -13.149 -4.009 -5.687 1.00 0.00 H new ATOM 0 HA3 GLY D 37 -12.166 -5.058 -4.685 1.00 0.00 H new ATOM 591 N ARG D 38 -10.533 -3.221 -6.848 1.00 0.00 N ATOM 592 CA ARG D 38 -9.422 -2.233 -6.948 1.00 0.00 C ATOM 593 C ARG D 38 -9.987 -0.813 -6.862 1.00 0.00 C ATOM 594 O ARG D 38 -11.115 -0.607 -6.461 1.00 0.00 O ATOM 595 CB ARG D 38 -8.689 -2.418 -8.278 1.00 0.00 C ATOM 596 CG ARG D 38 -9.565 -1.913 -9.425 1.00 0.00 C ATOM 597 CD ARG D 38 -9.352 -2.799 -10.654 1.00 0.00 C ATOM 598 NE ARG D 38 -7.945 -2.664 -11.128 1.00 0.00 N ATOM 599 CZ ARG D 38 -7.445 -3.550 -11.945 1.00 0.00 C ATOM 600 NH1 ARG D 38 -8.240 -4.298 -12.660 1.00 0.00 N ATOM 601 NH2 ARG D 38 -6.151 -3.691 -12.047 1.00 0.00 N ATOM 0 H ARG D 38 -10.832 -3.632 -7.732 1.00 0.00 H new ATOM 0 HA ARG D 38 -8.723 -2.391 -6.127 1.00 0.00 H new ATOM 0 HB2 ARG D 38 -7.745 -1.874 -8.262 1.00 0.00 H new ATOM 0 HB3 ARG D 38 -8.448 -3.470 -8.428 1.00 0.00 H new ATOM 0 HG2 ARG D 38 -10.614 -1.928 -9.130 1.00 0.00 H new ATOM 0 HG3 ARG D 38 -9.314 -0.879 -9.661 1.00 0.00 H new ATOM 0 HD2 ARG D 38 -9.565 -3.839 -10.407 1.00 0.00 H new ATOM 0 HD3 ARG D 38 -10.043 -2.512 -11.447 1.00 0.00 H new ATOM 0 HE ARG D 38 -7.374 -1.880 -10.814 1.00 0.00 H new ATOM 0 HH11 ARG D 38 -9.251 -4.190 -12.580 1.00 0.00 H new ATOM 0 HH12 ARG D 38 -7.850 -4.991 -13.299 1.00 0.00 H new ATOM 0 HH21 ARG D 38 -5.529 -3.108 -11.487 1.00 0.00 H new ATOM 0 HH22 ARG D 38 -5.762 -4.384 -12.686 1.00 0.00 H new ATOM 615 N LYS D 39 -9.208 0.170 -7.226 1.00 0.00 N ATOM 616 CA LYS D 39 -9.697 1.577 -7.154 1.00 0.00 C ATOM 617 C LYS D 39 -10.173 2.040 -8.530 1.00 0.00 C ATOM 618 O LYS D 39 -9.455 2.692 -9.262 1.00 0.00 O ATOM 619 CB LYS D 39 -8.565 2.485 -6.675 1.00 0.00 C ATOM 620 CG LYS D 39 -8.450 2.397 -5.152 1.00 0.00 C ATOM 621 CD LYS D 39 -6.983 2.539 -4.742 1.00 0.00 C ATOM 622 CE LYS D 39 -6.649 1.497 -3.674 1.00 0.00 C ATOM 623 NZ LYS D 39 -6.606 2.151 -2.336 1.00 0.00 N ATOM 0 H LYS D 39 -8.254 0.059 -7.570 1.00 0.00 H new ATOM 0 HA LYS D 39 -10.531 1.628 -6.454 1.00 0.00 H new ATOM 0 HB2 LYS D 39 -7.625 2.187 -7.139 1.00 0.00 H new ATOM 0 HB3 LYS D 39 -8.758 3.514 -6.977 1.00 0.00 H new ATOM 0 HG2 LYS D 39 -9.046 3.181 -4.686 1.00 0.00 H new ATOM 0 HG3 LYS D 39 -8.846 1.444 -4.801 1.00 0.00 H new ATOM 0 HD2 LYS D 39 -6.337 2.406 -5.610 1.00 0.00 H new ATOM 0 HD3 LYS D 39 -6.797 3.542 -4.358 1.00 0.00 H new ATOM 0 HE2 LYS D 39 -7.397 0.704 -3.679 1.00 0.00 H new ATOM 0 HE3 LYS D 39 -5.688 1.031 -3.894 1.00 0.00 H new ATOM 0 HZ1 LYS D 39 -6.379 1.442 -1.610 1.00 0.00 H new ATOM 0 HZ2 LYS D 39 -5.877 2.893 -2.335 1.00 0.00 H new ATOM 0 HZ3 LYS D 39 -7.532 2.576 -2.127 1.00 0.00 H new ATOM 637 N ILE D 40 -11.388 1.726 -8.874 1.00 0.00 N ATOM 638 CA ILE D 40 -11.931 2.163 -10.190 1.00 0.00 C ATOM 639 C ILE D 40 -13.034 3.189 -9.935 1.00 0.00 C ATOM 640 O ILE D 40 -14.153 2.845 -9.613 1.00 0.00 O ATOM 641 CB ILE D 40 -12.510 0.961 -10.940 1.00 0.00 C ATOM 642 CG1 ILE D 40 -11.684 -0.287 -10.625 1.00 0.00 C ATOM 643 CG2 ILE D 40 -12.470 1.230 -12.446 1.00 0.00 C ATOM 644 CD1 ILE D 40 -12.098 -1.423 -11.565 1.00 0.00 C ATOM 0 H ILE D 40 -12.032 1.183 -8.299 1.00 0.00 H new ATOM 0 HA ILE D 40 -11.138 2.602 -10.795 1.00 0.00 H new ATOM 0 HB ILE D 40 -13.542 0.803 -10.625 1.00 0.00 H new ATOM 0 HG12 ILE D 40 -10.622 -0.072 -10.742 1.00 0.00 H new ATOM 0 HG13 ILE D 40 -11.836 -0.585 -9.588 1.00 0.00 H new ATOM 0 HG21 ILE D 40 -12.882 0.374 -12.980 1.00 0.00 H new ATOM 0 HG22 ILE D 40 -13.060 2.118 -12.673 1.00 0.00 H new ATOM 0 HG23 ILE D 40 -11.439 1.390 -12.760 1.00 0.00 H new ATOM 0 HD11 ILE D 40 -11.510 -2.313 -11.341 1.00 0.00 H new ATOM 0 HD12 ILE D 40 -13.156 -1.643 -11.426 1.00 0.00 H new ATOM 0 HD13 ILE D 40 -11.923 -1.123 -12.598 1.00 0.00 H new ATOM 656 N PHE D 41 -12.722 4.448 -10.057 1.00 0.00 N ATOM 657 CA PHE D 41 -13.748 5.496 -9.802 1.00 0.00 C ATOM 658 C PHE D 41 -14.448 5.861 -11.114 1.00 0.00 C ATOM 659 O PHE D 41 -13.957 5.584 -12.189 1.00 0.00 O ATOM 660 CB PHE D 41 -13.060 6.725 -9.204 1.00 0.00 C ATOM 661 CG PHE D 41 -11.976 6.278 -8.244 1.00 0.00 C ATOM 662 CD1 PHE D 41 -12.115 5.076 -7.535 1.00 0.00 C ATOM 663 CD2 PHE D 41 -10.832 7.066 -8.058 1.00 0.00 C ATOM 664 CE1 PHE D 41 -11.115 4.667 -6.643 1.00 0.00 C ATOM 665 CE2 PHE D 41 -9.833 6.655 -7.168 1.00 0.00 C ATOM 666 CZ PHE D 41 -9.975 5.456 -6.459 1.00 0.00 C ATOM 0 H PHE D 41 -11.801 4.797 -10.322 1.00 0.00 H new ATOM 0 HA PHE D 41 -14.497 5.125 -9.102 1.00 0.00 H new ATOM 0 HB2 PHE D 41 -12.629 7.336 -9.997 1.00 0.00 H new ATOM 0 HB3 PHE D 41 -13.789 7.346 -8.683 1.00 0.00 H new ATOM 0 HD1 PHE D 41 -12.994 4.465 -7.677 1.00 0.00 H new ATOM 0 HD2 PHE D 41 -10.721 7.992 -8.602 1.00 0.00 H new ATOM 0 HE1 PHE D 41 -11.225 3.742 -6.097 1.00 0.00 H new ATOM 0 HE2 PHE D 41 -8.952 7.263 -7.028 1.00 0.00 H new ATOM 0 HZ PHE D 41 -9.205 5.141 -5.771 1.00 0.00 H new ATOM 676 N LEU D 42 -15.602 6.470 -11.032 1.00 0.00 N ATOM 677 CA LEU D 42 -16.342 6.839 -12.274 1.00 0.00 C ATOM 678 C LEU D 42 -16.681 8.332 -12.242 1.00 0.00 C ATOM 679 O LEU D 42 -17.161 8.848 -11.251 1.00 0.00 O ATOM 680 CB LEU D 42 -17.636 6.022 -12.343 1.00 0.00 C ATOM 681 CG LEU D 42 -17.689 5.230 -13.651 1.00 0.00 C ATOM 682 CD1 LEU D 42 -16.510 4.257 -13.716 1.00 0.00 C ATOM 683 CD2 LEU D 42 -18.995 4.436 -13.704 1.00 0.00 C ATOM 0 H LEU D 42 -16.063 6.727 -10.159 1.00 0.00 H new ATOM 0 HA LEU D 42 -15.725 6.629 -13.148 1.00 0.00 H new ATOM 0 HB2 LEU D 42 -17.691 5.341 -11.494 1.00 0.00 H new ATOM 0 HB3 LEU D 42 -18.498 6.685 -12.275 1.00 0.00 H new ATOM 0 HG LEU D 42 -17.636 5.920 -14.493 1.00 0.00 H new ATOM 0 HD11 LEU D 42 -16.553 3.696 -14.649 1.00 0.00 H new ATOM 0 HD12 LEU D 42 -15.575 4.815 -13.671 1.00 0.00 H new ATOM 0 HD13 LEU D 42 -16.562 3.566 -12.874 1.00 0.00 H new ATOM 0 HD21 LEU D 42 -19.039 3.869 -14.634 1.00 0.00 H new ATOM 0 HD22 LEU D 42 -19.038 3.750 -12.858 1.00 0.00 H new ATOM 0 HD23 LEU D 42 -19.840 5.123 -13.657 1.00 0.00 H new ATOM 695 N THR D 43 -16.436 9.031 -13.317 1.00 0.00 N ATOM 696 CA THR D 43 -16.745 10.490 -13.344 1.00 0.00 C ATOM 697 C THR D 43 -17.677 10.790 -14.521 1.00 0.00 C ATOM 698 O THR D 43 -17.246 10.895 -15.651 1.00 0.00 O ATOM 699 CB THR D 43 -15.440 11.276 -13.508 1.00 0.00 C ATOM 700 OG1 THR D 43 -14.737 11.285 -12.274 1.00 0.00 O ATOM 701 CG2 THR D 43 -15.747 12.716 -13.928 1.00 0.00 C ATOM 0 H THR D 43 -16.036 8.656 -14.177 1.00 0.00 H new ATOM 0 HA THR D 43 -17.233 10.782 -12.414 1.00 0.00 H new ATOM 0 HB THR D 43 -14.830 10.801 -14.276 1.00 0.00 H new ATOM 0 HG1 THR D 43 -13.780 11.161 -12.442 1.00 0.00 H new ATOM 0 HG21 THR D 43 -14.814 13.268 -14.043 1.00 0.00 H new ATOM 0 HG22 THR D 43 -16.285 12.712 -14.876 1.00 0.00 H new ATOM 0 HG23 THR D 43 -16.361 13.195 -13.165 1.00 0.00 H new ATOM 709 N ILE D 44 -18.949 10.928 -14.265 1.00 0.00 N ATOM 710 CA ILE D 44 -19.903 11.219 -15.376 1.00 0.00 C ATOM 711 C ILE D 44 -20.297 12.699 -15.341 1.00 0.00 C ATOM 712 O ILE D 44 -20.726 13.214 -14.329 1.00 0.00 O ATOM 713 CB ILE D 44 -21.161 10.353 -15.230 1.00 0.00 C ATOM 714 CG1 ILE D 44 -20.833 9.082 -14.440 1.00 0.00 C ATOM 715 CG2 ILE D 44 -21.670 9.962 -16.619 1.00 0.00 C ATOM 716 CD1 ILE D 44 -21.131 9.311 -12.957 1.00 0.00 C ATOM 0 H ILE D 44 -19.369 10.852 -13.339 1.00 0.00 H new ATOM 0 HA ILE D 44 -19.420 10.991 -16.326 1.00 0.00 H new ATOM 0 HB ILE D 44 -21.925 10.920 -14.699 1.00 0.00 H new ATOM 0 HG12 ILE D 44 -21.423 8.246 -14.815 1.00 0.00 H new ATOM 0 HG13 ILE D 44 -19.784 8.818 -14.574 1.00 0.00 H new ATOM 0 HG21 ILE D 44 -22.564 9.346 -16.519 1.00 0.00 H new ATOM 0 HG22 ILE D 44 -21.911 10.862 -17.185 1.00 0.00 H new ATOM 0 HG23 ILE D 44 -20.899 9.399 -17.144 1.00 0.00 H new ATOM 0 HD11 ILE D 44 -20.898 8.407 -12.395 1.00 0.00 H new ATOM 0 HD12 ILE D 44 -20.522 10.136 -12.587 1.00 0.00 H new ATOM 0 HD13 ILE D 44 -22.186 9.554 -12.831 1.00 0.00 H new ATOM 728 N ASN D 45 -20.156 13.385 -16.443 1.00 0.00 N ATOM 729 CA ASN D 45 -20.522 14.827 -16.482 1.00 0.00 C ATOM 730 C ASN D 45 -21.990 14.965 -16.894 1.00 0.00 C ATOM 731 O ASN D 45 -22.515 14.154 -17.635 1.00 0.00 O ATOM 732 CB ASN D 45 -19.634 15.553 -17.496 1.00 0.00 C ATOM 733 CG ASN D 45 -18.186 15.081 -17.340 1.00 0.00 C ATOM 734 OD1 ASN D 45 -17.392 15.209 -18.253 1.00 0.00 O ATOM 735 ND2 ASN D 45 -17.804 14.537 -16.217 1.00 0.00 N ATOM 0 H ASN D 45 -19.801 13.006 -17.321 1.00 0.00 H new ATOM 0 HA ASN D 45 -20.377 15.268 -15.496 1.00 0.00 H new ATOM 0 HB2 ASN D 45 -19.985 15.355 -18.509 1.00 0.00 H new ATOM 0 HB3 ASN D 45 -19.695 16.630 -17.342 1.00 0.00 H new ATOM 0 HD21 ASN D 45 -16.841 14.220 -16.106 1.00 0.00 H new ATOM 0 HD22 ASN D 45 -18.468 14.429 -15.451 1.00 0.00 H new ATOM 742 N ALA D 46 -22.652 15.989 -16.418 1.00 0.00 N ATOM 743 CA ALA D 46 -24.090 16.196 -16.762 1.00 0.00 C ATOM 744 C ALA D 46 -24.343 15.861 -18.235 1.00 0.00 C ATOM 745 O ALA D 46 -25.440 15.502 -18.615 1.00 0.00 O ATOM 746 CB ALA D 46 -24.465 17.658 -16.509 1.00 0.00 C ATOM 0 H ALA D 46 -22.253 16.696 -15.800 1.00 0.00 H new ATOM 0 HA ALA D 46 -24.698 15.539 -16.140 1.00 0.00 H new ATOM 0 HB1 ALA D 46 -25.515 17.813 -16.759 1.00 0.00 H new ATOM 0 HB2 ALA D 46 -24.303 17.899 -15.458 1.00 0.00 H new ATOM 0 HB3 ALA D 46 -23.845 18.305 -17.129 1.00 0.00 H new ATOM 752 N ASP D 47 -23.346 15.970 -19.069 1.00 0.00 N ATOM 753 CA ASP D 47 -23.548 15.654 -20.513 1.00 0.00 C ATOM 754 C ASP D 47 -23.384 14.147 -20.742 1.00 0.00 C ATOM 755 O ASP D 47 -22.939 13.716 -21.787 1.00 0.00 O ATOM 756 CB ASP D 47 -22.513 16.411 -21.348 1.00 0.00 C ATOM 757 CG ASP D 47 -22.897 16.338 -22.827 1.00 0.00 C ATOM 758 OD1 ASP D 47 -23.721 15.504 -23.163 1.00 0.00 O ATOM 759 OD2 ASP D 47 -22.361 17.117 -23.597 1.00 0.00 O ATOM 0 H ASP D 47 -22.403 16.263 -18.815 1.00 0.00 H new ATOM 0 HA ASP D 47 -24.552 15.956 -20.811 1.00 0.00 H new ATOM 0 HB2 ASP D 47 -22.461 17.451 -21.026 1.00 0.00 H new ATOM 0 HB3 ASP D 47 -21.523 15.980 -21.197 1.00 0.00 H new ATOM 764 N GLY D 48 -23.740 13.343 -19.777 1.00 0.00 N ATOM 765 CA GLY D 48 -23.603 11.869 -19.947 1.00 0.00 C ATOM 766 C GLY D 48 -22.175 11.539 -20.377 1.00 0.00 C ATOM 767 O GLY D 48 -21.939 10.594 -21.105 1.00 0.00 O ATOM 0 H GLY D 48 -24.119 13.643 -18.879 1.00 0.00 H new ATOM 0 HA2 GLY D 48 -23.840 11.360 -19.013 1.00 0.00 H new ATOM 0 HA3 GLY D 48 -24.312 11.510 -20.694 1.00 0.00 H new ATOM 771 N SER D 49 -21.219 12.307 -19.934 1.00 0.00 N ATOM 772 CA SER D 49 -19.806 12.031 -20.323 1.00 0.00 C ATOM 773 C SER D 49 -19.171 11.092 -19.298 1.00 0.00 C ATOM 774 O SER D 49 -18.756 11.505 -18.237 1.00 0.00 O ATOM 775 CB SER D 49 -19.023 13.344 -20.370 1.00 0.00 C ATOM 776 OG SER D 49 -18.494 13.527 -21.676 1.00 0.00 O ATOM 0 H SER D 49 -21.353 13.111 -19.321 1.00 0.00 H new ATOM 0 HA SER D 49 -19.784 11.562 -21.307 1.00 0.00 H new ATOM 0 HB2 SER D 49 -19.673 14.179 -20.108 1.00 0.00 H new ATOM 0 HB3 SER D 49 -18.216 13.326 -19.637 1.00 0.00 H new ATOM 0 HG SER D 49 -17.993 14.368 -21.711 1.00 0.00 H new ATOM 782 N VAL D 50 -19.088 9.828 -19.603 1.00 0.00 N ATOM 783 CA VAL D 50 -18.483 8.876 -18.632 1.00 0.00 C ATOM 784 C VAL D 50 -16.959 8.973 -18.693 1.00 0.00 C ATOM 785 O VAL D 50 -16.360 8.924 -19.750 1.00 0.00 O ATOM 786 CB VAL D 50 -18.916 7.450 -18.972 1.00 0.00 C ATOM 787 CG1 VAL D 50 -18.131 6.461 -18.108 1.00 0.00 C ATOM 788 CG2 VAL D 50 -20.412 7.291 -18.691 1.00 0.00 C ATOM 0 H VAL D 50 -19.411 9.415 -20.478 1.00 0.00 H new ATOM 0 HA VAL D 50 -18.821 9.128 -17.627 1.00 0.00 H new ATOM 0 HB VAL D 50 -18.719 7.252 -20.026 1.00 0.00 H new ATOM 0 HG11 VAL D 50 -18.439 5.443 -18.349 1.00 0.00 H new ATOM 0 HG12 VAL D 50 -17.065 6.574 -18.303 1.00 0.00 H new ATOM 0 HG13 VAL D 50 -18.330 6.660 -17.055 1.00 0.00 H new ATOM 0 HG21 VAL D 50 -20.722 6.274 -18.933 1.00 0.00 H new ATOM 0 HG22 VAL D 50 -20.607 7.488 -17.637 1.00 0.00 H new ATOM 0 HG23 VAL D 50 -20.974 7.997 -19.302 1.00 0.00 H new ATOM 798 N TYR D 51 -16.331 9.106 -17.559 1.00 0.00 N ATOM 799 CA TYR D 51 -14.846 9.201 -17.526 1.00 0.00 C ATOM 800 C TYR D 51 -14.339 8.460 -16.290 1.00 0.00 C ATOM 801 O TYR D 51 -14.109 9.047 -15.251 1.00 0.00 O ATOM 802 CB TYR D 51 -14.426 10.672 -17.456 1.00 0.00 C ATOM 803 CG TYR D 51 -12.936 10.763 -17.216 1.00 0.00 C ATOM 804 CD1 TYR D 51 -12.052 9.994 -17.982 1.00 0.00 C ATOM 805 CD2 TYR D 51 -12.440 11.620 -16.226 1.00 0.00 C ATOM 806 CE1 TYR D 51 -10.672 10.081 -17.757 1.00 0.00 C ATOM 807 CE2 TYR D 51 -11.061 11.707 -16.002 1.00 0.00 C ATOM 808 CZ TYR D 51 -10.177 10.938 -16.767 1.00 0.00 C ATOM 809 OH TYR D 51 -8.817 11.025 -16.545 1.00 0.00 O ATOM 0 H TYR D 51 -16.786 9.153 -16.647 1.00 0.00 H new ATOM 0 HA TYR D 51 -14.423 8.756 -18.426 1.00 0.00 H new ATOM 0 HB2 TYR D 51 -14.687 11.180 -18.385 1.00 0.00 H new ATOM 0 HB3 TYR D 51 -14.965 11.177 -16.654 1.00 0.00 H new ATOM 0 HD1 TYR D 51 -12.434 9.334 -18.746 1.00 0.00 H new ATOM 0 HD2 TYR D 51 -13.122 12.214 -15.635 1.00 0.00 H new ATOM 0 HE1 TYR D 51 -9.990 9.487 -18.347 1.00 0.00 H new ATOM 0 HE2 TYR D 51 -10.679 12.368 -15.238 1.00 0.00 H new ATOM 0 HH TYR D 51 -8.644 11.666 -15.824 1.00 0.00 H new ATOM 819 N ALA D 52 -14.176 7.171 -16.390 1.00 0.00 N ATOM 820 CA ALA D 52 -13.699 6.388 -15.219 1.00 0.00 C ATOM 821 C ALA D 52 -12.186 6.538 -15.085 1.00 0.00 C ATOM 822 O ALA D 52 -11.471 6.647 -16.062 1.00 0.00 O ATOM 823 CB ALA D 52 -14.051 4.912 -15.417 1.00 0.00 C ATOM 0 H ALA D 52 -14.353 6.626 -17.234 1.00 0.00 H new ATOM 0 HA ALA D 52 -14.180 6.759 -14.314 1.00 0.00 H new ATOM 0 HB1 ALA D 52 -13.702 4.337 -14.560 1.00 0.00 H new ATOM 0 HB2 ALA D 52 -15.132 4.805 -15.510 1.00 0.00 H new ATOM 0 HB3 ALA D 52 -13.570 4.542 -16.322 1.00 0.00 H new ATOM 829 N GLU D 53 -11.691 6.547 -13.880 1.00 0.00 N ATOM 830 CA GLU D 53 -10.226 6.691 -13.678 1.00 0.00 C ATOM 831 C GLU D 53 -9.724 5.552 -12.792 1.00 0.00 C ATOM 832 O GLU D 53 -10.445 5.029 -11.966 1.00 0.00 O ATOM 833 CB GLU D 53 -9.935 8.030 -12.997 1.00 0.00 C ATOM 834 CG GLU D 53 -10.597 9.161 -13.786 1.00 0.00 C ATOM 835 CD GLU D 53 -11.018 10.276 -12.827 1.00 0.00 C ATOM 836 OE1 GLU D 53 -10.147 10.986 -12.357 1.00 0.00 O ATOM 837 OE2 GLU D 53 -12.207 10.401 -12.580 1.00 0.00 O ATOM 0 H GLU D 53 -12.240 6.461 -13.025 1.00 0.00 H new ATOM 0 HA GLU D 53 -9.719 6.656 -14.642 1.00 0.00 H new ATOM 0 HB2 GLU D 53 -10.311 8.018 -11.974 1.00 0.00 H new ATOM 0 HB3 GLU D 53 -8.859 8.194 -12.940 1.00 0.00 H new ATOM 0 HG2 GLU D 53 -9.905 9.551 -14.532 1.00 0.00 H new ATOM 0 HG3 GLU D 53 -11.466 8.783 -14.324 1.00 0.00 H new ATOM 844 N GLU D 54 -8.487 5.178 -12.948 1.00 0.00 N ATOM 845 CA GLU D 54 -7.928 4.088 -12.106 1.00 0.00 C ATOM 846 C GLU D 54 -6.874 4.703 -11.195 1.00 0.00 C ATOM 847 O GLU D 54 -5.950 5.346 -11.651 1.00 0.00 O ATOM 848 CB GLU D 54 -7.288 3.018 -12.992 1.00 0.00 C ATOM 849 CG GLU D 54 -7.381 1.658 -12.294 1.00 0.00 C ATOM 850 CD GLU D 54 -8.310 0.738 -13.089 1.00 0.00 C ATOM 851 OE1 GLU D 54 -9.419 1.157 -13.379 1.00 0.00 O ATOM 852 OE2 GLU D 54 -7.897 -0.369 -13.391 1.00 0.00 O ATOM 0 H GLU D 54 -7.838 5.581 -13.624 1.00 0.00 H new ATOM 0 HA GLU D 54 -8.717 3.618 -11.518 1.00 0.00 H new ATOM 0 HB2 GLU D 54 -7.793 2.979 -13.957 1.00 0.00 H new ATOM 0 HB3 GLU D 54 -6.245 3.268 -13.188 1.00 0.00 H new ATOM 0 HG2 GLU D 54 -6.390 1.210 -12.213 1.00 0.00 H new ATOM 0 HG3 GLU D 54 -7.758 1.783 -11.279 1.00 0.00 H new ATOM 859 N VAL D 55 -7.013 4.541 -9.914 1.00 0.00 N ATOM 860 CA VAL D 55 -6.022 5.156 -8.993 1.00 0.00 C ATOM 861 C VAL D 55 -5.687 4.175 -7.872 1.00 0.00 C ATOM 862 O VAL D 55 -6.446 3.993 -6.942 1.00 0.00 O ATOM 863 CB VAL D 55 -6.600 6.449 -8.400 1.00 0.00 C ATOM 864 CG1 VAL D 55 -5.563 7.562 -8.531 1.00 0.00 C ATOM 865 CG2 VAL D 55 -7.868 6.864 -9.158 1.00 0.00 C ATOM 0 H VAL D 55 -7.763 4.014 -9.466 1.00 0.00 H new ATOM 0 HA VAL D 55 -5.113 5.392 -9.546 1.00 0.00 H new ATOM 0 HB VAL D 55 -6.849 6.278 -7.353 1.00 0.00 H new ATOM 0 HG11 VAL D 55 -5.965 8.485 -8.112 1.00 0.00 H new ATOM 0 HG12 VAL D 55 -4.659 7.282 -7.991 1.00 0.00 H new ATOM 0 HG13 VAL D 55 -5.324 7.715 -9.584 1.00 0.00 H new ATOM 0 HG21 VAL D 55 -8.266 7.782 -8.726 1.00 0.00 H new ATOM 0 HG22 VAL D 55 -7.626 7.032 -10.207 1.00 0.00 H new ATOM 0 HG23 VAL D 55 -8.614 6.073 -9.080 1.00 0.00 H new ATOM 875 N LYS D 56 -4.553 3.536 -7.963 1.00 0.00 N ATOM 876 CA LYS D 56 -4.161 2.559 -6.913 1.00 0.00 C ATOM 877 C LYS D 56 -2.632 2.424 -6.890 1.00 0.00 C ATOM 878 O LYS D 56 -2.011 2.305 -7.926 1.00 0.00 O ATOM 879 CB LYS D 56 -4.790 1.205 -7.250 1.00 0.00 C ATOM 880 CG LYS D 56 -4.120 0.100 -6.430 1.00 0.00 C ATOM 881 CD LYS D 56 -5.189 -0.711 -5.694 1.00 0.00 C ATOM 882 CE LYS D 56 -5.294 -2.100 -6.324 1.00 0.00 C ATOM 883 NZ LYS D 56 -4.896 -3.130 -5.323 1.00 0.00 N ATOM 0 H LYS D 56 -3.881 3.650 -8.722 1.00 0.00 H new ATOM 0 HA LYS D 56 -4.506 2.897 -5.936 1.00 0.00 H new ATOM 0 HB2 LYS D 56 -5.859 1.229 -7.039 1.00 0.00 H new ATOM 0 HB3 LYS D 56 -4.679 0.998 -8.314 1.00 0.00 H new ATOM 0 HG2 LYS D 56 -3.540 -0.552 -7.084 1.00 0.00 H new ATOM 0 HG3 LYS D 56 -3.423 0.536 -5.715 1.00 0.00 H new ATOM 0 HD2 LYS D 56 -4.933 -0.797 -4.638 1.00 0.00 H new ATOM 0 HD3 LYS D 56 -6.151 -0.201 -5.749 1.00 0.00 H new ATOM 0 HE2 LYS D 56 -6.314 -2.281 -6.663 1.00 0.00 H new ATOM 0 HE3 LYS D 56 -4.651 -2.163 -7.202 1.00 0.00 H new ATOM 0 HZ1 LYS D 56 -4.967 -4.075 -5.751 1.00 0.00 H new ATOM 0 HZ2 LYS D 56 -3.916 -2.960 -5.021 1.00 0.00 H new ATOM 0 HZ3 LYS D 56 -5.527 -3.075 -4.498 1.00 0.00 H new ATOM 897 N PRO D 57 -2.067 2.443 -5.710 1.00 0.00 N ATOM 898 CA PRO D 57 -0.608 2.323 -5.534 1.00 0.00 C ATOM 899 C PRO D 57 -0.168 0.866 -5.713 1.00 0.00 C ATOM 900 O PRO D 57 -0.952 -0.051 -5.566 1.00 0.00 O ATOM 901 CB PRO D 57 -0.379 2.796 -4.095 1.00 0.00 C ATOM 902 CG PRO D 57 -1.728 2.620 -3.359 1.00 0.00 C ATOM 903 CD PRO D 57 -2.820 2.584 -4.446 1.00 0.00 C ATOM 0 HA PRO D 57 -0.037 2.902 -6.260 1.00 0.00 H new ATOM 0 HB2 PRO D 57 0.405 2.211 -3.614 1.00 0.00 H new ATOM 0 HB3 PRO D 57 -0.058 3.838 -4.075 1.00 0.00 H new ATOM 0 HG2 PRO D 57 -1.733 1.700 -2.774 1.00 0.00 H new ATOM 0 HG3 PRO D 57 -1.900 3.441 -2.664 1.00 0.00 H new ATOM 0 HD2 PRO D 57 -3.505 1.750 -4.295 1.00 0.00 H new ATOM 0 HD3 PRO D 57 -3.420 3.494 -4.439 1.00 0.00 H new ATOM 911 N PHE D 58 1.078 0.645 -6.034 1.00 0.00 N ATOM 912 CA PHE D 58 1.559 -0.753 -6.224 1.00 0.00 C ATOM 913 C PHE D 58 2.382 -1.176 -4.997 1.00 0.00 C ATOM 914 O PHE D 58 2.763 -0.349 -4.193 1.00 0.00 O ATOM 915 CB PHE D 58 2.393 -0.831 -7.523 1.00 0.00 C ATOM 916 CG PHE D 58 3.868 -1.013 -7.229 1.00 0.00 C ATOM 917 CD1 PHE D 58 4.548 -0.076 -6.443 1.00 0.00 C ATOM 918 CD2 PHE D 58 4.553 -2.122 -7.745 1.00 0.00 C ATOM 919 CE1 PHE D 58 5.911 -0.245 -6.172 1.00 0.00 C ATOM 920 CE2 PHE D 58 5.915 -2.291 -7.475 1.00 0.00 C ATOM 921 CZ PHE D 58 6.595 -1.353 -6.687 1.00 0.00 C ATOM 0 H PHE D 58 1.782 1.370 -6.173 1.00 0.00 H new ATOM 0 HA PHE D 58 0.717 -1.438 -6.320 1.00 0.00 H new ATOM 0 HB2 PHE D 58 2.038 -1.661 -8.134 1.00 0.00 H new ATOM 0 HB3 PHE D 58 2.247 0.079 -8.105 1.00 0.00 H new ATOM 0 HD1 PHE D 58 4.021 0.778 -6.045 1.00 0.00 H new ATOM 0 HD2 PHE D 58 4.029 -2.846 -8.351 1.00 0.00 H new ATOM 0 HE1 PHE D 58 6.435 0.479 -5.566 1.00 0.00 H new ATOM 0 HE2 PHE D 58 6.443 -3.145 -7.874 1.00 0.00 H new ATOM 0 HZ PHE D 58 7.646 -1.485 -6.477 1.00 0.00 H new ATOM 931 N PRO D 59 2.624 -2.458 -4.891 1.00 0.00 N ATOM 932 CA PRO D 59 2.154 -3.450 -5.875 1.00 0.00 C ATOM 933 C PRO D 59 0.665 -3.746 -5.673 1.00 0.00 C ATOM 934 O PRO D 59 0.022 -3.185 -4.807 1.00 0.00 O ATOM 935 CB PRO D 59 3.004 -4.686 -5.572 1.00 0.00 C ATOM 936 CG PRO D 59 3.491 -4.534 -4.113 1.00 0.00 C ATOM 937 CD PRO D 59 3.391 -3.035 -3.770 1.00 0.00 C ATOM 0 HA PRO D 59 2.255 -3.111 -6.906 1.00 0.00 H new ATOM 0 HB2 PRO D 59 2.420 -5.598 -5.693 1.00 0.00 H new ATOM 0 HB3 PRO D 59 3.848 -4.754 -6.258 1.00 0.00 H new ATOM 0 HG2 PRO D 59 2.878 -5.128 -3.436 1.00 0.00 H new ATOM 0 HG3 PRO D 59 4.517 -4.888 -4.008 1.00 0.00 H new ATOM 0 HD2 PRO D 59 2.884 -2.877 -2.818 1.00 0.00 H new ATOM 0 HD3 PRO D 59 4.377 -2.579 -3.686 1.00 0.00 H new ATOM 1088 N GLN E 3 12.442 13.682 -8.967 1.00 0.00 N ATOM 1089 CA GLN E 3 12.697 12.824 -10.158 1.00 0.00 C ATOM 1090 C GLN E 3 11.446 12.004 -10.476 1.00 0.00 C ATOM 1091 O GLN E 3 11.046 11.146 -9.715 1.00 0.00 O ATOM 1092 CB GLN E 3 13.864 11.880 -9.865 1.00 0.00 C ATOM 1093 CG GLN E 3 14.891 11.973 -10.995 1.00 0.00 C ATOM 1094 CD GLN E 3 16.264 11.541 -10.476 1.00 0.00 C ATOM 1095 OE1 GLN E 3 17.278 11.899 -11.040 1.00 0.00 O ATOM 1096 NE2 GLN E 3 16.339 10.780 -9.420 1.00 0.00 N ATOM 0 HA GLN E 3 12.944 13.454 -11.012 1.00 0.00 H new ATOM 0 HB2 GLN E 3 14.328 12.143 -8.915 1.00 0.00 H new ATOM 0 HB3 GLN E 3 13.503 10.856 -9.771 1.00 0.00 H new ATOM 0 HG2 GLN E 3 14.589 11.338 -11.828 1.00 0.00 H new ATOM 0 HG3 GLN E 3 14.939 12.994 -11.374 1.00 0.00 H new ATOM 0 HE21 GLN E 3 15.487 10.479 -8.946 1.00 0.00 H new ATOM 0 HE22 GLN E 3 17.250 10.485 -9.067 1.00 0.00 H new ATOM 1105 N ARG E 4 10.822 12.262 -11.594 1.00 0.00 N ATOM 1106 CA ARG E 4 9.597 11.495 -11.955 1.00 0.00 C ATOM 1107 C ARG E 4 9.892 10.583 -13.149 1.00 0.00 C ATOM 1108 O ARG E 4 10.107 11.041 -14.254 1.00 0.00 O ATOM 1109 CB ARG E 4 8.477 12.471 -12.325 1.00 0.00 C ATOM 1110 CG ARG E 4 8.125 13.329 -11.108 1.00 0.00 C ATOM 1111 CD ARG E 4 7.393 12.471 -10.075 1.00 0.00 C ATOM 1112 NE ARG E 4 6.003 12.981 -9.905 1.00 0.00 N ATOM 1113 CZ ARG E 4 5.125 12.807 -10.854 1.00 0.00 C ATOM 1114 NH1 ARG E 4 5.116 11.694 -11.537 1.00 0.00 N ATOM 1115 NH2 ARG E 4 4.257 13.744 -11.124 1.00 0.00 N ATOM 0 H ARG E 4 11.108 12.969 -12.271 1.00 0.00 H new ATOM 0 HA ARG E 4 9.288 10.887 -11.105 1.00 0.00 H new ATOM 0 HB2 ARG E 4 8.793 13.107 -13.152 1.00 0.00 H new ATOM 0 HB3 ARG E 4 7.598 11.922 -12.662 1.00 0.00 H new ATOM 0 HG2 ARG E 4 9.031 13.749 -10.671 1.00 0.00 H new ATOM 0 HG3 ARG E 4 7.498 14.168 -11.410 1.00 0.00 H new ATOM 0 HD2 ARG E 4 7.373 11.430 -10.398 1.00 0.00 H new ATOM 0 HD3 ARG E 4 7.922 12.499 -9.122 1.00 0.00 H new ATOM 0 HE ARG E 4 5.738 13.466 -9.047 1.00 0.00 H new ATOM 0 HH11 ARG E 4 5.795 10.962 -11.328 1.00 0.00 H new ATOM 0 HH12 ARG E 4 4.430 11.557 -12.279 1.00 0.00 H new ATOM 0 HH21 ARG E 4 4.264 14.615 -10.592 1.00 0.00 H new ATOM 0 HH22 ARG E 4 3.572 13.606 -11.867 1.00 0.00 H new ATOM 1129 N ILE E 5 9.895 9.294 -12.937 1.00 0.00 N ATOM 1130 CA ILE E 5 10.167 8.353 -14.060 1.00 0.00 C ATOM 1131 C ILE E 5 9.168 7.199 -13.995 1.00 0.00 C ATOM 1132 O ILE E 5 8.782 6.765 -12.929 1.00 0.00 O ATOM 1133 CB ILE E 5 11.586 7.798 -13.938 1.00 0.00 C ATOM 1134 CG1 ILE E 5 12.558 8.938 -13.630 1.00 0.00 C ATOM 1135 CG2 ILE E 5 11.988 7.128 -15.255 1.00 0.00 C ATOM 1136 CD1 ILE E 5 12.781 9.020 -12.120 1.00 0.00 C ATOM 0 H ILE E 5 9.721 8.853 -12.034 1.00 0.00 H new ATOM 0 HA ILE E 5 10.067 8.880 -15.009 1.00 0.00 H new ATOM 0 HB ILE E 5 11.619 7.065 -13.132 1.00 0.00 H new ATOM 0 HG12 ILE E 5 13.506 8.770 -14.140 1.00 0.00 H new ATOM 0 HG13 ILE E 5 12.159 9.882 -14.002 1.00 0.00 H new ATOM 0 HG21 ILE E 5 13.000 6.732 -15.168 1.00 0.00 H new ATOM 0 HG22 ILE E 5 11.298 6.314 -15.475 1.00 0.00 H new ATOM 0 HG23 ILE E 5 11.953 7.861 -16.061 1.00 0.00 H new ATOM 0 HD11 ILE E 5 13.474 9.832 -11.898 1.00 0.00 H new ATOM 0 HD12 ILE E 5 11.830 9.208 -11.621 1.00 0.00 H new ATOM 0 HD13 ILE E 5 13.199 8.079 -11.762 1.00 0.00 H new ATOM 1148 N THR E 6 8.746 6.695 -15.121 1.00 0.00 N ATOM 1149 CA THR E 6 7.774 5.567 -15.108 1.00 0.00 C ATOM 1150 C THR E 6 8.507 4.273 -14.755 1.00 0.00 C ATOM 1151 O THR E 6 9.645 4.074 -15.125 1.00 0.00 O ATOM 1152 CB THR E 6 7.128 5.427 -16.490 1.00 0.00 C ATOM 1153 OG1 THR E 6 6.719 6.706 -16.952 1.00 0.00 O ATOM 1154 CG2 THR E 6 5.912 4.502 -16.397 1.00 0.00 C ATOM 0 H THR E 6 9.031 7.014 -16.047 1.00 0.00 H new ATOM 0 HA THR E 6 6.999 5.764 -14.367 1.00 0.00 H new ATOM 0 HB THR E 6 7.851 5.003 -17.187 1.00 0.00 H new ATOM 0 HG1 THR E 6 7.267 6.966 -17.722 1.00 0.00 H new ATOM 0 HG21 THR E 6 5.454 4.404 -17.381 1.00 0.00 H new ATOM 0 HG22 THR E 6 6.228 3.520 -16.044 1.00 0.00 H new ATOM 0 HG23 THR E 6 5.187 4.923 -15.700 1.00 0.00 H new ATOM 1162 N LEU E 7 7.863 3.389 -14.045 1.00 0.00 N ATOM 1163 CA LEU E 7 8.517 2.103 -13.670 1.00 0.00 C ATOM 1164 C LEU E 7 9.074 1.429 -14.927 1.00 0.00 C ATOM 1165 O LEU E 7 9.932 0.572 -14.856 1.00 0.00 O ATOM 1166 CB LEU E 7 7.480 1.183 -13.019 1.00 0.00 C ATOM 1167 CG LEU E 7 8.034 -0.239 -12.921 1.00 0.00 C ATOM 1168 CD1 LEU E 7 9.212 -0.265 -11.945 1.00 0.00 C ATOM 1169 CD2 LEU E 7 6.936 -1.179 -12.418 1.00 0.00 C ATOM 0 H LEU E 7 6.907 3.502 -13.707 1.00 0.00 H new ATOM 0 HA LEU E 7 9.330 2.296 -12.970 1.00 0.00 H new ATOM 0 HB2 LEU E 7 7.226 1.553 -12.026 1.00 0.00 H new ATOM 0 HB3 LEU E 7 6.561 1.185 -13.605 1.00 0.00 H new ATOM 0 HG LEU E 7 8.372 -0.565 -13.905 1.00 0.00 H new ATOM 0 HD11 LEU E 7 9.605 -1.279 -11.876 1.00 0.00 H new ATOM 0 HD12 LEU E 7 9.995 0.405 -12.302 1.00 0.00 H new ATOM 0 HD13 LEU E 7 8.876 0.061 -10.961 1.00 0.00 H new ATOM 0 HD21 LEU E 7 7.329 -2.193 -12.348 1.00 0.00 H new ATOM 0 HD22 LEU E 7 6.599 -0.851 -11.435 1.00 0.00 H new ATOM 0 HD23 LEU E 7 6.097 -1.163 -13.113 1.00 0.00 H new ATOM 1181 N LYS E 8 8.581 1.804 -16.073 1.00 0.00 N ATOM 1182 CA LYS E 8 9.063 1.183 -17.336 1.00 0.00 C ATOM 1183 C LYS E 8 10.317 1.905 -17.839 1.00 0.00 C ATOM 1184 O LYS E 8 11.206 1.301 -18.405 1.00 0.00 O ATOM 1185 CB LYS E 8 7.952 1.275 -18.385 1.00 0.00 C ATOM 1186 CG LYS E 8 7.877 2.702 -18.936 1.00 0.00 C ATOM 1187 CD LYS E 8 6.874 2.750 -20.089 1.00 0.00 C ATOM 1188 CE LYS E 8 6.209 4.127 -20.127 1.00 0.00 C ATOM 1189 NZ LYS E 8 6.172 4.622 -21.533 1.00 0.00 N ATOM 0 H LYS E 8 7.861 2.517 -16.189 1.00 0.00 H new ATOM 0 HA LYS E 8 9.317 0.139 -17.155 1.00 0.00 H new ATOM 0 HB2 LYS E 8 8.145 0.572 -19.195 1.00 0.00 H new ATOM 0 HB3 LYS E 8 6.996 0.996 -17.942 1.00 0.00 H new ATOM 0 HG2 LYS E 8 7.575 3.392 -18.148 1.00 0.00 H new ATOM 0 HG3 LYS E 8 8.860 3.022 -19.281 1.00 0.00 H new ATOM 0 HD2 LYS E 8 7.380 2.552 -21.034 1.00 0.00 H new ATOM 0 HD3 LYS E 8 6.120 1.973 -19.962 1.00 0.00 H new ATOM 0 HE2 LYS E 8 5.198 4.066 -19.725 1.00 0.00 H new ATOM 0 HE3 LYS E 8 6.760 4.826 -19.498 1.00 0.00 H new ATOM 0 HZ1 LYS E 8 5.720 5.558 -21.560 1.00 0.00 H new ATOM 0 HZ2 LYS E 8 7.142 4.695 -21.901 1.00 0.00 H new ATOM 0 HZ3 LYS E 8 5.628 3.958 -22.121 1.00 0.00 H new ATOM 1203 N ASP E 9 10.396 3.190 -17.642 1.00 0.00 N ATOM 1204 CA ASP E 9 11.593 3.944 -18.115 1.00 0.00 C ATOM 1205 C ASP E 9 12.751 3.731 -17.136 1.00 0.00 C ATOM 1206 O ASP E 9 13.907 3.839 -17.494 1.00 0.00 O ATOM 1207 CB ASP E 9 11.257 5.435 -18.196 1.00 0.00 C ATOM 1208 CG ASP E 9 10.119 5.648 -19.195 1.00 0.00 C ATOM 1209 OD1 ASP E 9 10.377 5.567 -20.385 1.00 0.00 O ATOM 1210 OD2 ASP E 9 9.007 5.889 -18.754 1.00 0.00 O ATOM 0 H ASP E 9 9.685 3.752 -17.174 1.00 0.00 H new ATOM 0 HA ASP E 9 11.883 3.584 -19.102 1.00 0.00 H new ATOM 0 HB2 ASP E 9 10.967 5.807 -17.213 1.00 0.00 H new ATOM 0 HB3 ASP E 9 12.136 6.001 -18.504 1.00 0.00 H new ATOM 1215 N TYR E 10 12.448 3.430 -15.903 1.00 0.00 N ATOM 1216 CA TYR E 10 13.526 3.207 -14.898 1.00 0.00 C ATOM 1217 C TYR E 10 14.021 1.764 -14.994 1.00 0.00 C ATOM 1218 O TYR E 10 15.185 1.485 -14.804 1.00 0.00 O ATOM 1219 CB TYR E 10 12.972 3.470 -13.492 1.00 0.00 C ATOM 1220 CG TYR E 10 14.042 3.209 -12.454 1.00 0.00 C ATOM 1221 CD1 TYR E 10 15.391 3.179 -12.827 1.00 0.00 C ATOM 1222 CD2 TYR E 10 13.682 3.001 -11.117 1.00 0.00 C ATOM 1223 CE1 TYR E 10 16.380 2.939 -11.865 1.00 0.00 C ATOM 1224 CE2 TYR E 10 14.672 2.761 -10.154 1.00 0.00 C ATOM 1225 CZ TYR E 10 16.020 2.731 -10.530 1.00 0.00 C ATOM 1226 OH TYR E 10 16.996 2.496 -9.582 1.00 0.00 O ATOM 0 H TYR E 10 11.497 3.329 -15.547 1.00 0.00 H new ATOM 0 HA TYR E 10 14.356 3.886 -15.094 1.00 0.00 H new ATOM 0 HB2 TYR E 10 12.625 4.500 -13.416 1.00 0.00 H new ATOM 0 HB3 TYR E 10 12.110 2.829 -13.306 1.00 0.00 H new ATOM 0 HD1 TYR E 10 15.669 3.341 -13.858 1.00 0.00 H new ATOM 0 HD2 TYR E 10 12.642 3.025 -10.828 1.00 0.00 H new ATOM 0 HE1 TYR E 10 17.420 2.915 -12.154 1.00 0.00 H new ATOM 0 HE2 TYR E 10 14.395 2.599 -9.123 1.00 0.00 H new ATOM 0 HH TYR E 10 16.909 1.581 -9.243 1.00 0.00 H new ATOM 1236 N ALA E 11 13.150 0.844 -15.295 1.00 0.00 N ATOM 1237 CA ALA E 11 13.584 -0.577 -15.406 1.00 0.00 C ATOM 1238 C ALA E 11 14.130 -0.833 -16.813 1.00 0.00 C ATOM 1239 O ALA E 11 14.870 -1.769 -17.043 1.00 0.00 O ATOM 1240 CB ALA E 11 12.390 -1.500 -15.148 1.00 0.00 C ATOM 0 H ALA E 11 12.159 1.012 -15.469 1.00 0.00 H new ATOM 0 HA ALA E 11 14.362 -0.777 -14.670 1.00 0.00 H new ATOM 0 HB1 ALA E 11 12.709 -2.539 -15.230 1.00 0.00 H new ATOM 0 HB2 ALA E 11 11.999 -1.318 -14.147 1.00 0.00 H new ATOM 0 HB3 ALA E 11 11.611 -1.301 -15.884 1.00 0.00 H new ATOM 1246 N MET E 12 13.763 -0.011 -17.758 1.00 0.00 N ATOM 1247 CA MET E 12 14.251 -0.207 -19.153 1.00 0.00 C ATOM 1248 C MET E 12 15.553 0.566 -19.369 1.00 0.00 C ATOM 1249 O MET E 12 16.489 0.072 -19.966 1.00 0.00 O ATOM 1250 CB MET E 12 13.196 0.309 -20.133 1.00 0.00 C ATOM 1251 CG MET E 12 12.007 -0.651 -20.160 1.00 0.00 C ATOM 1252 SD MET E 12 12.240 -1.858 -21.489 1.00 0.00 S ATOM 1253 CE MET E 12 10.602 -2.622 -21.389 1.00 0.00 C ATOM 0 H MET E 12 13.145 0.789 -17.624 1.00 0.00 H new ATOM 0 HA MET E 12 14.432 -1.269 -19.321 1.00 0.00 H new ATOM 0 HB2 MET E 12 12.866 1.304 -19.836 1.00 0.00 H new ATOM 0 HB3 MET E 12 13.626 0.400 -21.131 1.00 0.00 H new ATOM 0 HG2 MET E 12 11.916 -1.162 -19.201 1.00 0.00 H new ATOM 0 HG3 MET E 12 11.081 -0.097 -20.315 1.00 0.00 H new ATOM 0 HE1 MET E 12 10.523 -3.412 -22.136 1.00 0.00 H new ATOM 0 HE2 MET E 12 10.459 -3.047 -20.395 1.00 0.00 H new ATOM 0 HE3 MET E 12 9.837 -1.868 -21.575 1.00 0.00 H new ATOM 1263 N ARG E 13 15.611 1.781 -18.905 1.00 0.00 N ATOM 1264 CA ARG E 13 16.842 2.599 -19.100 1.00 0.00 C ATOM 1265 C ARG E 13 17.879 2.264 -18.026 1.00 0.00 C ATOM 1266 O ARG E 13 19.069 2.343 -18.257 1.00 0.00 O ATOM 1267 CB ARG E 13 16.481 4.083 -19.017 1.00 0.00 C ATOM 1268 CG ARG E 13 15.710 4.490 -20.274 1.00 0.00 C ATOM 1269 CD ARG E 13 15.776 6.008 -20.448 1.00 0.00 C ATOM 1270 NE ARG E 13 17.201 6.443 -20.464 1.00 0.00 N ATOM 1271 CZ ARG E 13 17.529 7.618 -20.002 1.00 0.00 C ATOM 1272 NH1 ARG E 13 16.806 8.663 -20.301 1.00 0.00 N ATOM 1273 NH2 ARG E 13 18.582 7.749 -19.241 1.00 0.00 N ATOM 0 H ARG E 13 14.858 2.246 -18.398 1.00 0.00 H new ATOM 0 HA ARG E 13 17.266 2.375 -20.079 1.00 0.00 H new ATOM 0 HB2 ARG E 13 15.877 4.273 -18.130 1.00 0.00 H new ATOM 0 HB3 ARG E 13 17.385 4.684 -18.921 1.00 0.00 H new ATOM 0 HG2 ARG E 13 16.133 3.995 -21.148 1.00 0.00 H new ATOM 0 HG3 ARG E 13 14.672 4.168 -20.196 1.00 0.00 H new ATOM 0 HD2 ARG E 13 15.285 6.300 -21.376 1.00 0.00 H new ATOM 0 HD3 ARG E 13 15.243 6.502 -19.636 1.00 0.00 H new ATOM 0 HE ARG E 13 17.920 5.822 -20.836 1.00 0.00 H new ATOM 0 HH11 ARG E 13 15.984 8.561 -20.896 1.00 0.00 H new ATOM 0 HH12 ARG E 13 17.063 9.581 -19.939 1.00 0.00 H new ATOM 0 HH21 ARG E 13 19.148 6.933 -19.008 1.00 0.00 H new ATOM 0 HH22 ARG E 13 18.839 8.668 -18.880 1.00 0.00 H new ATOM 1287 N PHE E 14 17.445 1.893 -16.855 1.00 0.00 N ATOM 1288 CA PHE E 14 18.423 1.561 -15.780 1.00 0.00 C ATOM 1289 C PHE E 14 18.443 0.047 -15.556 1.00 0.00 C ATOM 1290 O PHE E 14 19.405 -0.501 -15.054 1.00 0.00 O ATOM 1291 CB PHE E 14 18.025 2.269 -14.482 1.00 0.00 C ATOM 1292 CG PHE E 14 17.897 3.756 -14.732 1.00 0.00 C ATOM 1293 CD1 PHE E 14 16.903 4.246 -15.590 1.00 0.00 C ATOM 1294 CD2 PHE E 14 18.776 4.645 -14.103 1.00 0.00 C ATOM 1295 CE1 PHE E 14 16.789 5.623 -15.817 1.00 0.00 C ATOM 1296 CE2 PHE E 14 18.662 6.022 -14.329 1.00 0.00 C ATOM 1297 CZ PHE E 14 17.669 6.511 -15.186 1.00 0.00 C ATOM 0 H PHE E 14 16.463 1.805 -16.595 1.00 0.00 H new ATOM 0 HA PHE E 14 19.416 1.895 -16.080 1.00 0.00 H new ATOM 0 HB2 PHE E 14 17.080 1.870 -14.113 1.00 0.00 H new ATOM 0 HB3 PHE E 14 18.772 2.083 -13.711 1.00 0.00 H new ATOM 0 HD1 PHE E 14 16.224 3.561 -16.076 1.00 0.00 H new ATOM 0 HD2 PHE E 14 19.543 4.268 -13.443 1.00 0.00 H new ATOM 0 HE1 PHE E 14 16.023 6.000 -16.478 1.00 0.00 H new ATOM 0 HE2 PHE E 14 19.340 6.707 -13.842 1.00 0.00 H new ATOM 0 HZ PHE E 14 17.582 7.573 -15.361 1.00 0.00 H new ATOM 1307 N GLY E 15 17.396 -0.635 -15.930 1.00 0.00 N ATOM 1308 CA GLY E 15 17.366 -2.115 -15.744 1.00 0.00 C ATOM 1309 C GLY E 15 16.310 -2.484 -14.700 1.00 0.00 C ATOM 1310 O GLY E 15 16.063 -1.749 -13.764 1.00 0.00 O ATOM 0 H GLY E 15 16.561 -0.233 -16.356 1.00 0.00 H new ATOM 0 HA2 GLY E 15 17.141 -2.605 -16.691 1.00 0.00 H new ATOM 0 HA3 GLY E 15 18.346 -2.471 -15.425 1.00 0.00 H new ATOM 1314 N GLN E 16 15.686 -3.622 -14.853 1.00 0.00 N ATOM 1315 CA GLN E 16 14.648 -4.041 -13.870 1.00 0.00 C ATOM 1316 C GLN E 16 15.323 -4.434 -12.554 1.00 0.00 C ATOM 1317 O GLN E 16 14.714 -4.417 -11.504 1.00 0.00 O ATOM 1318 CB GLN E 16 13.876 -5.241 -14.424 1.00 0.00 C ATOM 1319 CG GLN E 16 12.978 -4.785 -15.575 1.00 0.00 C ATOM 1320 CD GLN E 16 12.470 -6.007 -16.341 1.00 0.00 C ATOM 1321 OE1 GLN E 16 12.165 -7.024 -15.751 1.00 0.00 O ATOM 1322 NE2 GLN E 16 12.365 -5.949 -17.639 1.00 0.00 N ATOM 0 H GLN E 16 15.851 -4.278 -15.616 1.00 0.00 H new ATOM 0 HA GLN E 16 13.959 -3.215 -13.694 1.00 0.00 H new ATOM 0 HB2 GLN E 16 14.572 -6.005 -14.772 1.00 0.00 H new ATOM 0 HB3 GLN E 16 13.274 -5.694 -13.637 1.00 0.00 H new ATOM 0 HG2 GLN E 16 12.137 -4.210 -15.188 1.00 0.00 H new ATOM 0 HG3 GLN E 16 13.533 -4.128 -16.245 1.00 0.00 H new ATOM 0 HE21 GLN E 16 12.621 -5.095 -18.134 1.00 0.00 H new ATOM 0 HE22 GLN E 16 12.027 -6.758 -18.160 1.00 0.00 H new ATOM 1331 N THR E 17 16.577 -4.790 -12.605 1.00 0.00 N ATOM 1332 CA THR E 17 17.291 -5.184 -11.360 1.00 0.00 C ATOM 1333 C THR E 17 17.535 -3.943 -10.498 1.00 0.00 C ATOM 1334 O THR E 17 17.615 -4.023 -9.287 1.00 0.00 O ATOM 1335 CB THR E 17 18.632 -5.827 -11.723 1.00 0.00 C ATOM 1336 OG1 THR E 17 18.398 -7.023 -12.452 1.00 0.00 O ATOM 1337 CG2 THR E 17 19.410 -6.150 -10.446 1.00 0.00 C ATOM 0 H THR E 17 17.138 -4.825 -13.456 1.00 0.00 H new ATOM 0 HA THR E 17 16.685 -5.899 -10.803 1.00 0.00 H new ATOM 0 HB THR E 17 19.213 -5.135 -12.333 1.00 0.00 H new ATOM 0 HG1 THR E 17 19.255 -7.436 -12.687 1.00 0.00 H new ATOM 0 HG21 THR E 17 20.364 -6.608 -10.707 1.00 0.00 H new ATOM 0 HG22 THR E 17 19.589 -5.232 -9.887 1.00 0.00 H new ATOM 0 HG23 THR E 17 18.832 -6.841 -9.833 1.00 0.00 H new ATOM 1345 N LYS E 18 17.652 -2.796 -11.110 1.00 0.00 N ATOM 1346 CA LYS E 18 17.889 -1.554 -10.321 1.00 0.00 C ATOM 1347 C LYS E 18 16.558 -1.039 -9.774 1.00 0.00 C ATOM 1348 O LYS E 18 16.458 -0.637 -8.631 1.00 0.00 O ATOM 1349 CB LYS E 18 18.524 -0.487 -11.219 1.00 0.00 C ATOM 1350 CG LYS E 18 20.047 -0.629 -11.176 1.00 0.00 C ATOM 1351 CD LYS E 18 20.696 0.554 -11.899 1.00 0.00 C ATOM 1352 CE LYS E 18 21.828 0.042 -12.793 1.00 0.00 C ATOM 1353 NZ LYS E 18 22.807 1.139 -13.035 1.00 0.00 N ATOM 0 H LYS E 18 17.594 -2.665 -12.120 1.00 0.00 H new ATOM 0 HA LYS E 18 18.562 -1.773 -9.492 1.00 0.00 H new ATOM 0 HB2 LYS E 18 18.166 -0.597 -12.243 1.00 0.00 H new ATOM 0 HB3 LYS E 18 18.231 0.508 -10.884 1.00 0.00 H new ATOM 0 HG2 LYS E 18 20.389 -0.668 -10.142 1.00 0.00 H new ATOM 0 HG3 LYS E 18 20.348 -1.565 -11.647 1.00 0.00 H new ATOM 0 HD2 LYS E 18 19.953 1.080 -12.499 1.00 0.00 H new ATOM 0 HD3 LYS E 18 21.085 1.269 -11.174 1.00 0.00 H new ATOM 0 HE2 LYS E 18 22.325 -0.805 -12.319 1.00 0.00 H new ATOM 0 HE3 LYS E 18 21.424 -0.315 -13.741 1.00 0.00 H new ATOM 0 HZ1 LYS E 18 23.576 0.790 -13.642 1.00 0.00 H new ATOM 0 HZ2 LYS E 18 22.328 1.934 -13.504 1.00 0.00 H new ATOM 0 HZ3 LYS E 18 23.201 1.459 -12.127 1.00 0.00 H new ATOM 1367 N THR E 19 15.533 -1.051 -10.579 1.00 0.00 N ATOM 1368 CA THR E 19 14.206 -0.567 -10.103 1.00 0.00 C ATOM 1369 C THR E 19 13.698 -1.489 -8.993 1.00 0.00 C ATOM 1370 O THR E 19 13.086 -1.051 -8.039 1.00 0.00 O ATOM 1371 CB THR E 19 13.209 -0.574 -11.266 1.00 0.00 C ATOM 1372 OG1 THR E 19 13.774 0.109 -12.378 1.00 0.00 O ATOM 1373 CG2 THR E 19 11.913 0.119 -10.834 1.00 0.00 C ATOM 0 H THR E 19 15.556 -1.375 -11.546 1.00 0.00 H new ATOM 0 HA THR E 19 14.307 0.448 -9.719 1.00 0.00 H new ATOM 0 HB THR E 19 12.987 -1.603 -11.551 1.00 0.00 H new ATOM 0 HG1 THR E 19 13.803 1.071 -12.191 1.00 0.00 H new ATOM 0 HG21 THR E 19 11.204 0.114 -11.662 1.00 0.00 H new ATOM 0 HG22 THR E 19 11.483 -0.411 -9.984 1.00 0.00 H new ATOM 0 HG23 THR E 19 12.129 1.148 -10.548 1.00 0.00 H new ATOM 1381 N ALA E 20 13.945 -2.765 -9.112 1.00 0.00 N ATOM 1382 CA ALA E 20 13.476 -3.716 -8.066 1.00 0.00 C ATOM 1383 C ALA E 20 14.391 -3.619 -6.843 1.00 0.00 C ATOM 1384 O ALA E 20 14.002 -3.943 -5.739 1.00 0.00 O ATOM 1385 CB ALA E 20 13.513 -5.142 -8.621 1.00 0.00 C ATOM 0 H ALA E 20 14.452 -3.190 -9.889 1.00 0.00 H new ATOM 0 HA ALA E 20 12.455 -3.466 -7.776 1.00 0.00 H new ATOM 0 HB1 ALA E 20 13.170 -5.839 -7.856 1.00 0.00 H new ATOM 0 HB2 ALA E 20 12.862 -5.210 -9.493 1.00 0.00 H new ATOM 0 HB3 ALA E 20 14.533 -5.394 -8.910 1.00 0.00 H new ATOM 1391 N LYS E 21 15.603 -3.176 -7.030 1.00 0.00 N ATOM 1392 CA LYS E 21 16.540 -3.057 -5.878 1.00 0.00 C ATOM 1393 C LYS E 21 16.183 -1.815 -5.060 1.00 0.00 C ATOM 1394 O LYS E 21 16.325 -1.790 -3.854 1.00 0.00 O ATOM 1395 CB LYS E 21 17.975 -2.937 -6.395 1.00 0.00 C ATOM 1396 CG LYS E 21 18.954 -3.069 -5.226 1.00 0.00 C ATOM 1397 CD LYS E 21 19.176 -4.549 -4.911 1.00 0.00 C ATOM 1398 CE LYS E 21 20.187 -4.682 -3.769 1.00 0.00 C ATOM 1399 NZ LYS E 21 21.570 -4.593 -4.316 1.00 0.00 N ATOM 0 H LYS E 21 15.986 -2.891 -7.932 1.00 0.00 H new ATOM 0 HA LYS E 21 16.457 -3.943 -5.248 1.00 0.00 H new ATOM 0 HB2 LYS E 21 18.171 -3.712 -7.136 1.00 0.00 H new ATOM 0 HB3 LYS E 21 18.114 -1.977 -6.893 1.00 0.00 H new ATOM 0 HG2 LYS E 21 19.902 -2.593 -5.476 1.00 0.00 H new ATOM 0 HG3 LYS E 21 18.561 -2.555 -4.349 1.00 0.00 H new ATOM 0 HD2 LYS E 21 18.232 -5.018 -4.632 1.00 0.00 H new ATOM 0 HD3 LYS E 21 19.541 -5.069 -5.796 1.00 0.00 H new ATOM 0 HE2 LYS E 21 20.025 -3.895 -3.032 1.00 0.00 H new ATOM 0 HE3 LYS E 21 20.048 -5.633 -3.255 1.00 0.00 H new ATOM 0 HZ1 LYS E 21 22.257 -4.683 -3.540 1.00 0.00 H new ATOM 0 HZ2 LYS E 21 21.721 -5.359 -5.003 1.00 0.00 H new ATOM 0 HZ3 LYS E 21 21.699 -3.675 -4.787 1.00 0.00 H new ATOM 1413 N ASP E 22 15.717 -0.785 -5.709 1.00 0.00 N ATOM 1414 CA ASP E 22 15.347 0.455 -4.971 1.00 0.00 C ATOM 1415 C ASP E 22 13.977 0.266 -4.320 1.00 0.00 C ATOM 1416 O ASP E 22 13.739 0.700 -3.211 1.00 0.00 O ATOM 1417 CB ASP E 22 15.292 1.631 -5.946 1.00 0.00 C ATOM 1418 CG ASP E 22 16.337 2.673 -5.546 1.00 0.00 C ATOM 1419 OD1 ASP E 22 17.511 2.341 -5.559 1.00 0.00 O ATOM 1420 OD2 ASP E 22 15.946 3.785 -5.231 1.00 0.00 O ATOM 0 H ASP E 22 15.576 -0.748 -6.719 1.00 0.00 H new ATOM 0 HA ASP E 22 16.091 0.658 -4.201 1.00 0.00 H new ATOM 0 HB2 ASP E 22 15.479 1.284 -6.962 1.00 0.00 H new ATOM 0 HB3 ASP E 22 14.297 2.077 -5.939 1.00 0.00 H new ATOM 1425 N LEU E 23 13.077 -0.385 -5.001 1.00 0.00 N ATOM 1426 CA LEU E 23 11.721 -0.609 -4.427 1.00 0.00 C ATOM 1427 C LEU E 23 11.780 -1.759 -3.419 1.00 0.00 C ATOM 1428 O LEU E 23 10.970 -1.849 -2.518 1.00 0.00 O ATOM 1429 CB LEU E 23 10.742 -0.961 -5.549 1.00 0.00 C ATOM 1430 CG LEU E 23 10.299 0.317 -6.260 1.00 0.00 C ATOM 1431 CD1 LEU E 23 10.307 0.091 -7.773 1.00 0.00 C ATOM 1432 CD2 LEU E 23 8.885 0.686 -5.808 1.00 0.00 C ATOM 0 H LEU E 23 13.222 -0.773 -5.933 1.00 0.00 H new ATOM 0 HA LEU E 23 11.384 0.298 -3.925 1.00 0.00 H new ATOM 0 HB2 LEU E 23 11.215 -1.639 -6.259 1.00 0.00 H new ATOM 0 HB3 LEU E 23 9.876 -1.481 -5.140 1.00 0.00 H new ATOM 0 HG LEU E 23 10.985 1.127 -6.011 1.00 0.00 H new ATOM 0 HD11 LEU E 23 9.991 1.003 -8.279 1.00 0.00 H new ATOM 0 HD12 LEU E 23 11.314 -0.173 -8.096 1.00 0.00 H new ATOM 0 HD13 LEU E 23 9.622 -0.719 -8.024 1.00 0.00 H new ATOM 0 HD21 LEU E 23 8.567 1.598 -6.314 1.00 0.00 H new ATOM 0 HD22 LEU E 23 8.200 -0.125 -6.057 1.00 0.00 H new ATOM 0 HD23 LEU E 23 8.878 0.848 -4.730 1.00 0.00 H new ATOM 1444 N GLY E 24 12.736 -2.637 -3.562 1.00 0.00 N ATOM 1445 CA GLY E 24 12.846 -3.779 -2.611 1.00 0.00 C ATOM 1446 C GLY E 24 11.842 -4.867 -2.996 1.00 0.00 C ATOM 1447 O GLY E 24 11.399 -5.637 -2.167 1.00 0.00 O ATOM 0 H GLY E 24 13.444 -2.612 -4.295 1.00 0.00 H new ATOM 0 HA2 GLY E 24 13.858 -4.182 -2.627 1.00 0.00 H new ATOM 0 HA3 GLY E 24 12.655 -3.438 -1.594 1.00 0.00 H new ATOM 1451 N VAL E 25 11.481 -4.937 -4.247 1.00 0.00 N ATOM 1452 CA VAL E 25 10.505 -5.977 -4.685 1.00 0.00 C ATOM 1453 C VAL E 25 11.261 -7.120 -5.365 1.00 0.00 C ATOM 1454 O VAL E 25 12.475 -7.162 -5.361 1.00 0.00 O ATOM 1455 CB VAL E 25 9.503 -5.367 -5.675 1.00 0.00 C ATOM 1456 CG1 VAL E 25 8.124 -5.990 -5.453 1.00 0.00 C ATOM 1457 CG2 VAL E 25 9.412 -3.852 -5.459 1.00 0.00 C ATOM 0 H VAL E 25 11.819 -4.320 -4.986 1.00 0.00 H new ATOM 0 HA VAL E 25 9.965 -6.356 -3.817 1.00 0.00 H new ATOM 0 HB VAL E 25 9.840 -5.567 -6.692 1.00 0.00 H new ATOM 0 HG11 VAL E 25 7.412 -5.557 -6.156 1.00 0.00 H new ATOM 0 HG12 VAL E 25 8.181 -7.067 -5.611 1.00 0.00 H new ATOM 0 HG13 VAL E 25 7.794 -5.790 -4.433 1.00 0.00 H new ATOM 0 HG21 VAL E 25 8.699 -3.426 -6.165 1.00 0.00 H new ATOM 0 HG22 VAL E 25 9.080 -3.649 -4.441 1.00 0.00 H new ATOM 0 HG23 VAL E 25 10.392 -3.402 -5.617 1.00 0.00 H new ATOM 1467 N TYR E 26 10.555 -8.048 -5.949 1.00 0.00 N ATOM 1468 CA TYR E 26 11.236 -9.187 -6.629 1.00 0.00 C ATOM 1469 C TYR E 26 11.255 -8.935 -8.137 1.00 0.00 C ATOM 1470 O TYR E 26 10.540 -8.093 -8.644 1.00 0.00 O ATOM 1471 CB TYR E 26 10.487 -10.497 -6.346 1.00 0.00 C ATOM 1472 CG TYR E 26 9.627 -10.348 -5.113 1.00 0.00 C ATOM 1473 CD1 TYR E 26 10.219 -10.070 -3.875 1.00 0.00 C ATOM 1474 CD2 TYR E 26 8.238 -10.486 -5.210 1.00 0.00 C ATOM 1475 CE1 TYR E 26 9.420 -9.929 -2.735 1.00 0.00 C ATOM 1476 CE2 TYR E 26 7.439 -10.345 -4.069 1.00 0.00 C ATOM 1477 CZ TYR E 26 8.031 -10.067 -2.832 1.00 0.00 C ATOM 1478 OH TYR E 26 7.244 -9.928 -1.707 1.00 0.00 O ATOM 0 H TYR E 26 9.536 -8.068 -5.985 1.00 0.00 H new ATOM 0 HA TYR E 26 12.255 -9.269 -6.251 1.00 0.00 H new ATOM 0 HB2 TYR E 26 9.866 -10.762 -7.202 1.00 0.00 H new ATOM 0 HB3 TYR E 26 11.200 -11.309 -6.205 1.00 0.00 H new ATOM 0 HD1 TYR E 26 11.291 -9.965 -3.800 1.00 0.00 H new ATOM 0 HD2 TYR E 26 7.782 -10.701 -6.165 1.00 0.00 H new ATOM 0 HE1 TYR E 26 9.876 -9.714 -1.780 1.00 0.00 H new ATOM 0 HE2 TYR E 26 6.367 -10.451 -4.144 1.00 0.00 H new ATOM 0 HH TYR E 26 6.303 -10.053 -1.949 1.00 0.00 H new ATOM 1488 N GLN E 27 12.062 -9.661 -8.861 1.00 0.00 N ATOM 1489 CA GLN E 27 12.117 -9.463 -10.336 1.00 0.00 C ATOM 1490 C GLN E 27 10.794 -9.917 -10.955 1.00 0.00 C ATOM 1491 O GLN E 27 10.422 -9.490 -12.030 1.00 0.00 O ATOM 1492 CB GLN E 27 13.267 -10.284 -10.919 1.00 0.00 C ATOM 1493 CG GLN E 27 14.512 -9.403 -11.042 1.00 0.00 C ATOM 1494 CD GLN E 27 15.678 -10.234 -11.581 1.00 0.00 C ATOM 1495 OE1 GLN E 27 15.527 -10.968 -12.537 1.00 0.00 O ATOM 1496 NE2 GLN E 27 16.845 -10.148 -11.004 1.00 0.00 N ATOM 0 H GLN E 27 12.685 -10.381 -8.495 1.00 0.00 H new ATOM 0 HA GLN E 27 12.280 -8.409 -10.559 1.00 0.00 H new ATOM 0 HB2 GLN E 27 13.477 -11.141 -10.279 1.00 0.00 H new ATOM 0 HB3 GLN E 27 12.988 -10.677 -11.897 1.00 0.00 H new ATOM 0 HG2 GLN E 27 14.312 -8.564 -11.708 1.00 0.00 H new ATOM 0 HG3 GLN E 27 14.770 -8.983 -10.070 1.00 0.00 H new ATOM 0 HE21 GLN E 27 16.973 -9.532 -10.201 1.00 0.00 H new ATOM 0 HE22 GLN E 27 17.630 -10.697 -11.356 1.00 0.00 H new ATOM 1505 N SER E 28 10.078 -10.777 -10.283 1.00 0.00 N ATOM 1506 CA SER E 28 8.778 -11.255 -10.831 1.00 0.00 C ATOM 1507 C SER E 28 7.711 -10.181 -10.615 1.00 0.00 C ATOM 1508 O SER E 28 6.669 -10.192 -11.241 1.00 0.00 O ATOM 1509 CB SER E 28 8.365 -12.539 -10.110 1.00 0.00 C ATOM 1510 OG SER E 28 7.453 -13.263 -10.926 1.00 0.00 O ATOM 0 H SER E 28 10.338 -11.169 -9.378 1.00 0.00 H new ATOM 0 HA SER E 28 8.881 -11.455 -11.898 1.00 0.00 H new ATOM 0 HB2 SER E 28 9.243 -13.149 -9.897 1.00 0.00 H new ATOM 0 HB3 SER E 28 7.903 -12.300 -9.152 1.00 0.00 H new ATOM 0 HG SER E 28 7.187 -14.087 -10.468 1.00 0.00 H new ATOM 1516 N ALA E 29 7.970 -9.244 -9.745 1.00 0.00 N ATOM 1517 CA ALA E 29 6.977 -8.162 -9.500 1.00 0.00 C ATOM 1518 C ALA E 29 7.230 -7.051 -10.511 1.00 0.00 C ATOM 1519 O ALA E 29 6.322 -6.385 -10.969 1.00 0.00 O ATOM 1520 CB ALA E 29 7.149 -7.622 -8.079 1.00 0.00 C ATOM 0 H ALA E 29 8.826 -9.181 -9.194 1.00 0.00 H new ATOM 0 HA ALA E 29 5.962 -8.544 -9.608 1.00 0.00 H new ATOM 0 HB1 ALA E 29 6.422 -6.830 -7.900 1.00 0.00 H new ATOM 0 HB2 ALA E 29 6.992 -8.428 -7.362 1.00 0.00 H new ATOM 0 HB3 ALA E 29 8.156 -7.223 -7.961 1.00 0.00 H new ATOM 1526 N ILE E 30 8.466 -6.865 -10.872 1.00 0.00 N ATOM 1527 CA ILE E 30 8.808 -5.819 -11.865 1.00 0.00 C ATOM 1528 C ILE E 30 8.459 -6.337 -13.259 1.00 0.00 C ATOM 1529 O ILE E 30 8.159 -5.580 -14.161 1.00 0.00 O ATOM 1530 CB ILE E 30 10.305 -5.530 -11.788 1.00 0.00 C ATOM 1531 CG1 ILE E 30 10.694 -5.230 -10.337 1.00 0.00 C ATOM 1532 CG2 ILE E 30 10.638 -4.328 -12.669 1.00 0.00 C ATOM 1533 CD1 ILE E 30 10.222 -3.826 -9.953 1.00 0.00 C ATOM 0 H ILE E 30 9.260 -7.399 -10.517 1.00 0.00 H new ATOM 0 HA ILE E 30 8.251 -4.905 -11.660 1.00 0.00 H new ATOM 0 HB ILE E 30 10.862 -6.399 -12.138 1.00 0.00 H new ATOM 0 HG12 ILE E 30 10.247 -5.968 -9.671 1.00 0.00 H new ATOM 0 HG13 ILE E 30 11.775 -5.306 -10.218 1.00 0.00 H new ATOM 0 HG21 ILE E 30 11.707 -4.122 -12.614 1.00 0.00 H new ATOM 0 HG22 ILE E 30 10.363 -4.546 -13.701 1.00 0.00 H new ATOM 0 HG23 ILE E 30 10.082 -3.457 -12.322 1.00 0.00 H new ATOM 0 HD11 ILE E 30 10.501 -3.618 -8.920 1.00 0.00 H new ATOM 0 HD12 ILE E 30 10.689 -3.093 -10.610 1.00 0.00 H new ATOM 0 HD13 ILE E 30 9.138 -3.766 -10.055 1.00 0.00 H new ATOM 1545 N ASN E 31 8.494 -7.629 -13.436 1.00 0.00 N ATOM 1546 CA ASN E 31 8.160 -8.213 -14.764 1.00 0.00 C ATOM 1547 C ASN E 31 6.641 -8.221 -14.941 1.00 0.00 C ATOM 1548 O ASN E 31 6.132 -7.963 -16.013 1.00 0.00 O ATOM 1549 CB ASN E 31 8.692 -9.646 -14.839 1.00 0.00 C ATOM 1550 CG ASN E 31 9.570 -9.801 -16.082 1.00 0.00 C ATOM 1551 OD1 ASN E 31 10.236 -8.870 -16.490 1.00 0.00 O ATOM 1552 ND2 ASN E 31 9.600 -10.946 -16.706 1.00 0.00 N ATOM 0 H ASN E 31 8.741 -8.307 -12.715 1.00 0.00 H new ATOM 0 HA ASN E 31 8.617 -7.617 -15.554 1.00 0.00 H new ATOM 0 HB2 ASN E 31 9.268 -9.879 -13.943 1.00 0.00 H new ATOM 0 HB3 ASN E 31 7.862 -10.352 -14.877 1.00 0.00 H new ATOM 0 HD21 ASN E 31 10.182 -11.059 -17.536 1.00 0.00 H new ATOM 0 HD22 ASN E 31 9.041 -11.728 -16.364 1.00 0.00 H new ATOM 1559 N LYS E 32 5.912 -8.513 -13.896 1.00 0.00 N ATOM 1560 CA LYS E 32 4.427 -8.534 -14.011 1.00 0.00 C ATOM 1561 C LYS E 32 3.904 -7.108 -14.200 1.00 0.00 C ATOM 1562 O LYS E 32 2.919 -6.884 -14.874 1.00 0.00 O ATOM 1563 CB LYS E 32 3.817 -9.142 -12.745 1.00 0.00 C ATOM 1564 CG LYS E 32 4.004 -8.177 -11.577 1.00 0.00 C ATOM 1565 CD LYS E 32 3.137 -8.621 -10.398 1.00 0.00 C ATOM 1566 CE LYS E 32 3.648 -9.959 -9.861 1.00 0.00 C ATOM 1567 NZ LYS E 32 2.836 -11.069 -10.435 1.00 0.00 N ATOM 0 H LYS E 32 6.281 -8.737 -12.972 1.00 0.00 H new ATOM 0 HA LYS E 32 4.144 -9.139 -14.872 1.00 0.00 H new ATOM 0 HB2 LYS E 32 2.757 -9.342 -12.899 1.00 0.00 H new ATOM 0 HB3 LYS E 32 4.293 -10.097 -12.522 1.00 0.00 H new ATOM 0 HG2 LYS E 32 5.052 -8.149 -11.280 1.00 0.00 H new ATOM 0 HG3 LYS E 32 3.732 -7.166 -11.881 1.00 0.00 H new ATOM 0 HD2 LYS E 32 3.163 -7.868 -9.611 1.00 0.00 H new ATOM 0 HD3 LYS E 32 2.098 -8.717 -10.713 1.00 0.00 H new ATOM 0 HE2 LYS E 32 4.698 -10.090 -10.122 1.00 0.00 H new ATOM 0 HE3 LYS E 32 3.586 -9.974 -8.773 1.00 0.00 H new ATOM 0 HZ1 LYS E 32 2.185 -11.433 -9.711 1.00 0.00 H new ATOM 0 HZ2 LYS E 32 2.289 -10.716 -11.246 1.00 0.00 H new ATOM 0 HZ3 LYS E 32 3.467 -11.834 -10.749 1.00 0.00 H new ATOM 1581 N ALA E 33 4.556 -6.141 -13.612 1.00 0.00 N ATOM 1582 CA ALA E 33 4.088 -4.734 -13.766 1.00 0.00 C ATOM 1583 C ALA E 33 4.400 -4.246 -15.180 1.00 0.00 C ATOM 1584 O ALA E 33 3.600 -3.584 -15.811 1.00 0.00 O ATOM 1585 CB ALA E 33 4.802 -3.845 -12.747 1.00 0.00 C ATOM 0 H ALA E 33 5.388 -6.264 -13.035 1.00 0.00 H new ATOM 0 HA ALA E 33 3.012 -4.687 -13.596 1.00 0.00 H new ATOM 0 HB1 ALA E 33 4.460 -2.816 -12.859 1.00 0.00 H new ATOM 0 HB2 ALA E 33 4.578 -4.194 -11.739 1.00 0.00 H new ATOM 0 HB3 ALA E 33 5.878 -3.890 -12.915 1.00 0.00 H new ATOM 1591 N ILE E 34 5.554 -4.576 -15.687 1.00 0.00 N ATOM 1592 CA ILE E 34 5.914 -4.139 -17.065 1.00 0.00 C ATOM 1593 C ILE E 34 5.174 -5.019 -18.073 1.00 0.00 C ATOM 1594 O ILE E 34 5.007 -4.662 -19.223 1.00 0.00 O ATOM 1595 CB ILE E 34 7.425 -4.276 -17.269 1.00 0.00 C ATOM 1596 CG1 ILE E 34 8.142 -3.152 -16.516 1.00 0.00 C ATOM 1597 CG2 ILE E 34 7.757 -4.180 -18.760 1.00 0.00 C ATOM 1598 CD1 ILE E 34 9.600 -3.547 -16.277 1.00 0.00 C ATOM 0 H ILE E 34 6.264 -5.129 -15.207 1.00 0.00 H new ATOM 0 HA ILE E 34 5.630 -3.097 -17.209 1.00 0.00 H new ATOM 0 HB ILE E 34 7.754 -5.243 -16.888 1.00 0.00 H new ATOM 0 HG12 ILE E 34 8.094 -2.227 -17.091 1.00 0.00 H new ATOM 0 HG13 ILE E 34 7.645 -2.962 -15.565 1.00 0.00 H new ATOM 0 HG21 ILE E 34 8.834 -4.278 -18.900 1.00 0.00 H new ATOM 0 HG22 ILE E 34 7.247 -4.979 -19.299 1.00 0.00 H new ATOM 0 HG23 ILE E 34 7.427 -3.215 -19.145 1.00 0.00 H new ATOM 0 HD11 ILE E 34 10.111 -2.747 -15.741 1.00 0.00 H new ATOM 0 HD12 ILE E 34 9.637 -4.461 -15.685 1.00 0.00 H new ATOM 0 HD13 ILE E 34 10.093 -3.715 -17.234 1.00 0.00 H new ATOM 1610 N HIS E 35 4.724 -6.167 -17.646 1.00 0.00 N ATOM 1611 CA HIS E 35 3.989 -7.072 -18.572 1.00 0.00 C ATOM 1612 C HIS E 35 2.577 -6.526 -18.787 1.00 0.00 C ATOM 1613 O HIS E 35 1.933 -6.808 -19.778 1.00 0.00 O ATOM 1614 CB HIS E 35 3.908 -8.471 -17.958 1.00 0.00 C ATOM 1615 CG HIS E 35 5.208 -9.195 -18.182 1.00 0.00 C ATOM 1616 ND1 HIS E 35 5.311 -10.576 -18.094 1.00 0.00 N ATOM 1617 CD2 HIS E 35 6.468 -8.745 -18.487 1.00 0.00 C ATOM 1618 CE1 HIS E 35 6.593 -10.903 -18.341 1.00 0.00 C ATOM 1619 NE2 HIS E 35 7.341 -9.824 -18.587 1.00 0.00 N ATOM 0 H HIS E 35 4.834 -6.517 -16.694 1.00 0.00 H new ATOM 0 HA HIS E 35 4.511 -7.127 -19.527 1.00 0.00 H new ATOM 0 HB2 HIS E 35 3.699 -8.399 -16.891 1.00 0.00 H new ATOM 0 HB3 HIS E 35 3.087 -9.030 -18.407 1.00 0.00 H new ATOM 0 HD2 HIS E 35 6.741 -7.710 -18.628 1.00 0.00 H new ATOM 0 HE1 HIS E 35 6.971 -11.915 -18.340 1.00 0.00 H new ATOM 0 HE2 HIS E 35 8.338 -9.797 -18.802 1.00 0.00 H new ATOM 1627 N ALA E 36 2.092 -5.744 -17.861 1.00 0.00 N ATOM 1628 CA ALA E 36 0.724 -5.175 -18.005 1.00 0.00 C ATOM 1629 C ALA E 36 0.790 -3.903 -18.850 1.00 0.00 C ATOM 1630 O ALA E 36 -0.199 -3.453 -19.392 1.00 0.00 O ATOM 1631 CB ALA E 36 0.166 -4.837 -16.620 1.00 0.00 C ATOM 0 H ALA E 36 2.586 -5.475 -17.010 1.00 0.00 H new ATOM 0 HA ALA E 36 0.075 -5.903 -18.492 1.00 0.00 H new ATOM 0 HB1 ALA E 36 -0.836 -4.420 -16.723 1.00 0.00 H new ATOM 0 HB2 ALA E 36 0.122 -5.742 -16.015 1.00 0.00 H new ATOM 0 HB3 ALA E 36 0.814 -4.107 -16.135 1.00 0.00 H new ATOM 1637 N GLY E 37 1.952 -3.318 -18.966 1.00 0.00 N ATOM 1638 CA GLY E 37 2.081 -2.073 -19.775 1.00 0.00 C ATOM 1639 C GLY E 37 1.108 -1.020 -19.244 1.00 0.00 C ATOM 1640 O GLY E 37 0.683 -0.135 -19.961 1.00 0.00 O ATOM 0 H GLY E 37 2.816 -3.648 -18.536 1.00 0.00 H new ATOM 0 HA2 GLY E 37 3.103 -1.698 -19.725 1.00 0.00 H new ATOM 0 HA3 GLY E 37 1.870 -2.284 -20.823 1.00 0.00 H new ATOM 1644 N ARG E 38 0.750 -1.106 -17.991 1.00 0.00 N ATOM 1645 CA ARG E 38 -0.196 -0.107 -17.418 1.00 0.00 C ATOM 1646 C ARG E 38 0.542 1.210 -17.170 1.00 0.00 C ATOM 1647 O ARG E 38 1.698 1.360 -17.515 1.00 0.00 O ATOM 1648 CB ARG E 38 -0.755 -0.635 -16.095 1.00 0.00 C ATOM 1649 CG ARG E 38 -2.264 -0.391 -16.043 1.00 0.00 C ATOM 1650 CD ARG E 38 -2.967 -1.643 -15.513 1.00 0.00 C ATOM 1651 NE ARG E 38 -3.445 -2.466 -16.660 1.00 0.00 N ATOM 1652 CZ ARG E 38 -4.642 -2.987 -16.634 1.00 0.00 C ATOM 1653 NH1 ARG E 38 -5.146 -3.411 -15.507 1.00 0.00 N ATOM 1654 NH2 ARG E 38 -5.333 -3.086 -17.736 1.00 0.00 N ATOM 0 H ARG E 38 1.071 -1.823 -17.341 1.00 0.00 H new ATOM 0 HA ARG E 38 -1.015 0.061 -18.117 1.00 0.00 H new ATOM 0 HB2 ARG E 38 -0.545 -1.700 -15.999 1.00 0.00 H new ATOM 0 HB3 ARG E 38 -0.267 -0.137 -15.257 1.00 0.00 H new ATOM 0 HG2 ARG E 38 -2.483 0.461 -15.400 1.00 0.00 H new ATOM 0 HG3 ARG E 38 -2.638 -0.145 -17.037 1.00 0.00 H new ATOM 0 HD2 ARG E 38 -2.282 -2.224 -14.895 1.00 0.00 H new ATOM 0 HD3 ARG E 38 -3.807 -1.361 -14.879 1.00 0.00 H new ATOM 0 HE ARG E 38 -2.838 -2.622 -17.464 1.00 0.00 H new ATOM 0 HH11 ARG E 38 -4.605 -3.335 -14.646 1.00 0.00 H new ATOM 0 HH12 ARG E 38 -6.081 -3.818 -15.488 1.00 0.00 H new ATOM 0 HH21 ARG E 38 -4.938 -2.757 -18.617 1.00 0.00 H new ATOM 0 HH22 ARG E 38 -6.268 -3.493 -17.717 1.00 0.00 H new ATOM 1668 N LYS E 39 -0.117 2.163 -16.574 1.00 0.00 N ATOM 1669 CA LYS E 39 0.543 3.471 -16.302 1.00 0.00 C ATOM 1670 C LYS E 39 1.037 3.500 -14.861 1.00 0.00 C ATOM 1671 O LYS E 39 0.492 4.178 -14.012 1.00 0.00 O ATOM 1672 CB LYS E 39 -0.457 4.602 -16.534 1.00 0.00 C ATOM 1673 CG LYS E 39 -0.154 5.293 -17.867 1.00 0.00 C ATOM 1674 CD LYS E 39 -0.875 4.559 -19.000 1.00 0.00 C ATOM 1675 CE LYS E 39 -1.496 5.576 -19.958 1.00 0.00 C ATOM 1676 NZ LYS E 39 -0.415 6.291 -20.695 1.00 0.00 N ATOM 0 H LYS E 39 -1.086 2.093 -16.263 1.00 0.00 H new ATOM 0 HA LYS E 39 1.392 3.601 -16.973 1.00 0.00 H new ATOM 0 HB2 LYS E 39 -1.473 4.207 -16.541 1.00 0.00 H new ATOM 0 HB3 LYS E 39 -0.401 5.323 -15.718 1.00 0.00 H new ATOM 0 HG2 LYS E 39 -0.477 6.333 -17.831 1.00 0.00 H new ATOM 0 HG3 LYS E 39 0.921 5.299 -18.049 1.00 0.00 H new ATOM 0 HD2 LYS E 39 -0.174 3.920 -19.537 1.00 0.00 H new ATOM 0 HD3 LYS E 39 -1.649 3.910 -18.591 1.00 0.00 H new ATOM 0 HE2 LYS E 39 -2.158 5.071 -20.662 1.00 0.00 H new ATOM 0 HE3 LYS E 39 -2.105 6.289 -19.403 1.00 0.00 H new ATOM 0 HZ1 LYS E 39 -0.837 6.909 -21.417 1.00 0.00 H new ATOM 0 HZ2 LYS E 39 0.138 6.866 -20.028 1.00 0.00 H new ATOM 0 HZ3 LYS E 39 0.209 5.598 -21.154 1.00 0.00 H new ATOM 1690 N ILE E 40 2.084 2.779 -14.590 1.00 0.00 N ATOM 1691 CA ILE E 40 2.648 2.765 -13.215 1.00 0.00 C ATOM 1692 C ILE E 40 3.761 3.802 -13.153 1.00 0.00 C ATOM 1693 O ILE E 40 4.883 3.548 -13.539 1.00 0.00 O ATOM 1694 CB ILE E 40 3.213 1.380 -12.898 1.00 0.00 C ATOM 1695 CG1 ILE E 40 2.076 0.356 -12.878 1.00 0.00 C ATOM 1696 CG2 ILE E 40 3.895 1.408 -11.527 1.00 0.00 C ATOM 1697 CD1 ILE E 40 2.663 -1.056 -12.888 1.00 0.00 C ATOM 0 H ILE E 40 2.577 2.195 -15.265 1.00 0.00 H new ATOM 0 HA ILE E 40 1.872 2.997 -12.486 1.00 0.00 H new ATOM 0 HB ILE E 40 3.940 1.102 -13.661 1.00 0.00 H new ATOM 0 HG12 ILE E 40 1.459 0.499 -11.991 1.00 0.00 H new ATOM 0 HG13 ILE E 40 1.428 0.499 -13.743 1.00 0.00 H new ATOM 0 HG21 ILE E 40 4.298 0.421 -11.301 1.00 0.00 H new ATOM 0 HG22 ILE E 40 4.706 2.137 -11.539 1.00 0.00 H new ATOM 0 HG23 ILE E 40 3.168 1.687 -10.764 1.00 0.00 H new ATOM 0 HD11 ILE E 40 1.854 -1.786 -12.874 1.00 0.00 H new ATOM 0 HD12 ILE E 40 3.261 -1.195 -13.788 1.00 0.00 H new ATOM 0 HD13 ILE E 40 3.292 -1.195 -12.009 1.00 0.00 H new ATOM 1709 N PHE E 41 3.453 4.976 -12.691 1.00 0.00 N ATOM 1710 CA PHE E 41 4.484 6.042 -12.628 1.00 0.00 C ATOM 1711 C PHE E 41 5.356 5.855 -11.386 1.00 0.00 C ATOM 1712 O PHE E 41 4.973 5.203 -10.435 1.00 0.00 O ATOM 1713 CB PHE E 41 3.780 7.395 -12.584 1.00 0.00 C ATOM 1714 CG PHE E 41 2.643 7.396 -13.585 1.00 0.00 C ATOM 1715 CD1 PHE E 41 2.704 6.578 -14.723 1.00 0.00 C ATOM 1716 CD2 PHE E 41 1.531 8.222 -13.381 1.00 0.00 C ATOM 1717 CE1 PHE E 41 1.658 6.591 -15.651 1.00 0.00 C ATOM 1718 CE2 PHE E 41 0.485 8.232 -14.309 1.00 0.00 C ATOM 1719 CZ PHE E 41 0.549 7.419 -15.445 1.00 0.00 C ATOM 0 H PHE E 41 2.529 5.245 -12.353 1.00 0.00 H new ATOM 0 HA PHE E 41 5.128 5.991 -13.506 1.00 0.00 H new ATOM 0 HB2 PHE E 41 3.398 7.588 -11.581 1.00 0.00 H new ATOM 0 HB3 PHE E 41 4.485 8.193 -12.815 1.00 0.00 H new ATOM 0 HD1 PHE E 41 3.559 5.938 -14.882 1.00 0.00 H new ATOM 0 HD2 PHE E 41 1.481 8.852 -12.506 1.00 0.00 H new ATOM 0 HE1 PHE E 41 1.706 5.962 -16.527 1.00 0.00 H new ATOM 0 HE2 PHE E 41 -0.373 8.868 -14.148 1.00 0.00 H new ATOM 0 HZ PHE E 41 -0.257 7.430 -16.163 1.00 0.00 H new ATOM 1729 N LEU E 42 6.537 6.412 -11.397 1.00 0.00 N ATOM 1730 CA LEU E 42 7.447 6.258 -10.228 1.00 0.00 C ATOM 1731 C LEU E 42 7.861 7.634 -9.701 1.00 0.00 C ATOM 1732 O LEU E 42 8.586 8.364 -10.347 1.00 0.00 O ATOM 1733 CB LEU E 42 8.694 5.488 -10.668 1.00 0.00 C ATOM 1734 CG LEU E 42 8.931 4.306 -9.732 1.00 0.00 C ATOM 1735 CD1 LEU E 42 7.781 3.312 -9.869 1.00 0.00 C ATOM 1736 CD2 LEU E 42 10.240 3.615 -10.112 1.00 0.00 C ATOM 0 H LEU E 42 6.910 6.968 -12.167 1.00 0.00 H new ATOM 0 HA LEU E 42 6.931 5.715 -9.436 1.00 0.00 H new ATOM 0 HB2 LEU E 42 8.571 5.134 -11.692 1.00 0.00 H new ATOM 0 HB3 LEU E 42 9.561 6.148 -10.661 1.00 0.00 H new ATOM 0 HG LEU E 42 8.987 4.662 -8.703 1.00 0.00 H new ATOM 0 HD11 LEU E 42 7.949 2.467 -9.201 1.00 0.00 H new ATOM 0 HD12 LEU E 42 6.843 3.802 -9.606 1.00 0.00 H new ATOM 0 HD13 LEU E 42 7.728 2.956 -10.898 1.00 0.00 H new ATOM 0 HD21 LEU E 42 10.412 2.770 -9.445 1.00 0.00 H new ATOM 0 HD22 LEU E 42 10.178 3.259 -11.140 1.00 0.00 H new ATOM 0 HD23 LEU E 42 11.064 4.322 -10.022 1.00 0.00 H new ATOM 1748 N THR E 43 7.417 7.991 -8.526 1.00 0.00 N ATOM 1749 CA THR E 43 7.795 9.315 -7.955 1.00 0.00 C ATOM 1750 C THR E 43 8.979 9.129 -7.001 1.00 0.00 C ATOM 1751 O THR E 43 8.806 8.865 -5.829 1.00 0.00 O ATOM 1752 CB THR E 43 6.604 9.900 -7.190 1.00 0.00 C ATOM 1753 OG1 THR E 43 5.537 10.146 -8.095 1.00 0.00 O ATOM 1754 CG2 THR E 43 7.021 11.210 -6.518 1.00 0.00 C ATOM 0 H THR E 43 6.809 7.422 -7.937 1.00 0.00 H new ATOM 0 HA THR E 43 8.076 9.997 -8.758 1.00 0.00 H new ATOM 0 HB THR E 43 6.277 9.193 -6.428 1.00 0.00 H new ATOM 0 HG1 THR E 43 4.773 10.519 -7.607 1.00 0.00 H new ATOM 0 HG21 THR E 43 6.173 11.626 -5.974 1.00 0.00 H new ATOM 0 HG22 THR E 43 7.839 11.018 -5.824 1.00 0.00 H new ATOM 0 HG23 THR E 43 7.348 11.920 -7.277 1.00 0.00 H new ATOM 1762 N ILE E 44 10.180 9.256 -7.497 1.00 0.00 N ATOM 1763 CA ILE E 44 11.373 9.074 -6.618 1.00 0.00 C ATOM 1764 C ILE E 44 11.688 10.376 -5.879 1.00 0.00 C ATOM 1765 O ILE E 44 11.906 11.408 -6.481 1.00 0.00 O ATOM 1766 CB ILE E 44 12.585 8.672 -7.463 1.00 0.00 C ATOM 1767 CG1 ILE E 44 12.121 7.916 -8.711 1.00 0.00 C ATOM 1768 CG2 ILE E 44 13.503 7.770 -6.635 1.00 0.00 C ATOM 1769 CD1 ILE E 44 13.326 7.264 -9.393 1.00 0.00 C ATOM 0 H ILE E 44 10.388 9.477 -8.471 1.00 0.00 H new ATOM 0 HA ILE E 44 11.154 8.290 -5.893 1.00 0.00 H new ATOM 0 HB ILE E 44 13.125 9.569 -7.767 1.00 0.00 H new ATOM 0 HG12 ILE E 44 11.390 7.156 -8.437 1.00 0.00 H new ATOM 0 HG13 ILE E 44 11.626 8.600 -9.400 1.00 0.00 H new ATOM 0 HG21 ILE E 44 14.367 7.482 -7.234 1.00 0.00 H new ATOM 0 HG22 ILE E 44 13.839 8.308 -5.749 1.00 0.00 H new ATOM 0 HG23 ILE E 44 12.958 6.876 -6.332 1.00 0.00 H new ATOM 0 HD11 ILE E 44 12.994 6.726 -10.281 1.00 0.00 H new ATOM 0 HD12 ILE E 44 14.042 8.034 -9.681 1.00 0.00 H new ATOM 0 HD13 ILE E 44 13.801 6.567 -8.703 1.00 0.00 H new ATOM 1781 N ASN E 45 11.723 10.330 -4.574 1.00 0.00 N ATOM 1782 CA ASN E 45 12.034 11.553 -3.785 1.00 0.00 C ATOM 1783 C ASN E 45 13.543 11.625 -3.543 1.00 0.00 C ATOM 1784 O ASN E 45 14.206 10.614 -3.404 1.00 0.00 O ATOM 1785 CB ASN E 45 11.301 11.494 -2.444 1.00 0.00 C ATOM 1786 CG ASN E 45 9.791 11.489 -2.691 1.00 0.00 C ATOM 1787 OD1 ASN E 45 9.318 10.861 -3.618 1.00 0.00 O ATOM 1788 ND2 ASN E 45 9.011 12.169 -1.899 1.00 0.00 N ATOM 0 H ASN E 45 11.548 9.492 -4.019 1.00 0.00 H new ATOM 0 HA ASN E 45 11.710 12.437 -4.334 1.00 0.00 H new ATOM 0 HB2 ASN E 45 11.594 10.599 -1.896 1.00 0.00 H new ATOM 0 HB3 ASN E 45 11.577 12.350 -1.828 1.00 0.00 H new ATOM 0 HD21 ASN E 45 8.003 12.174 -2.057 1.00 0.00 H new ATOM 0 HD22 ASN E 45 9.408 12.696 -1.121 1.00 0.00 H new ATOM 1795 N ALA E 46 14.088 12.813 -3.491 1.00 0.00 N ATOM 1796 CA ALA E 46 15.556 12.964 -3.262 1.00 0.00 C ATOM 1797 C ALA E 46 16.033 11.964 -2.204 1.00 0.00 C ATOM 1798 O ALA E 46 17.182 11.567 -2.188 1.00 0.00 O ATOM 1799 CB ALA E 46 15.851 14.387 -2.785 1.00 0.00 C ATOM 0 H ALA E 46 13.577 13.689 -3.598 1.00 0.00 H new ATOM 0 HA ALA E 46 16.083 12.770 -4.196 1.00 0.00 H new ATOM 0 HB1 ALA E 46 16.922 14.500 -2.617 1.00 0.00 H new ATOM 0 HB2 ALA E 46 15.525 15.100 -3.543 1.00 0.00 H new ATOM 0 HB3 ALA E 46 15.316 14.577 -1.855 1.00 0.00 H new ATOM 1805 N ASP E 47 15.166 11.553 -1.320 1.00 0.00 N ATOM 1806 CA ASP E 47 15.577 10.580 -0.270 1.00 0.00 C ATOM 1807 C ASP E 47 15.420 9.153 -0.803 1.00 0.00 C ATOM 1808 O ASP E 47 15.084 8.242 -0.074 1.00 0.00 O ATOM 1809 CB ASP E 47 14.694 10.762 0.965 1.00 0.00 C ATOM 1810 CG ASP E 47 15.394 11.684 1.965 1.00 0.00 C ATOM 1811 OD1 ASP E 47 15.756 12.783 1.575 1.00 0.00 O ATOM 1812 OD2 ASP E 47 15.557 11.279 3.103 1.00 0.00 O ATOM 0 H ASP E 47 14.191 11.849 -1.280 1.00 0.00 H new ATOM 0 HA ASP E 47 16.619 10.754 -0.002 1.00 0.00 H new ATOM 0 HB2 ASP E 47 13.731 11.185 0.677 1.00 0.00 H new ATOM 0 HB3 ASP E 47 14.492 9.795 1.426 1.00 0.00 H new ATOM 1817 N GLY E 48 15.660 8.953 -2.069 1.00 0.00 N ATOM 1818 CA GLY E 48 15.524 7.585 -2.645 1.00 0.00 C ATOM 1819 C GLY E 48 14.157 7.012 -2.274 1.00 0.00 C ATOM 1820 O GLY E 48 14.008 5.826 -2.060 1.00 0.00 O ATOM 0 H GLY E 48 15.944 9.676 -2.729 1.00 0.00 H new ATOM 0 HA2 GLY E 48 15.633 7.622 -3.729 1.00 0.00 H new ATOM 0 HA3 GLY E 48 16.316 6.939 -2.267 1.00 0.00 H new ATOM 1824 N SER E 49 13.156 7.844 -2.194 1.00 0.00 N ATOM 1825 CA SER E 49 11.801 7.336 -1.832 1.00 0.00 C ATOM 1826 C SER E 49 11.041 6.949 -3.102 1.00 0.00 C ATOM 1827 O SER E 49 10.449 7.778 -3.761 1.00 0.00 O ATOM 1828 CB SER E 49 11.029 8.426 -1.087 1.00 0.00 C ATOM 1829 OG SER E 49 10.342 7.843 0.010 1.00 0.00 O ATOM 0 H SER E 49 13.215 8.848 -2.362 1.00 0.00 H new ATOM 0 HA SER E 49 11.903 6.460 -1.191 1.00 0.00 H new ATOM 0 HB2 SER E 49 11.714 9.197 -0.735 1.00 0.00 H new ATOM 0 HB3 SER E 49 10.321 8.911 -1.759 1.00 0.00 H new ATOM 0 HG SER E 49 9.847 8.538 0.492 1.00 0.00 H new ATOM 1835 N VAL E 50 11.049 5.694 -3.452 1.00 0.00 N ATOM 1836 CA VAL E 50 10.326 5.266 -4.680 1.00 0.00 C ATOM 1837 C VAL E 50 8.831 5.153 -4.381 1.00 0.00 C ATOM 1838 O VAL E 50 8.378 4.206 -3.769 1.00 0.00 O ATOM 1839 CB VAL E 50 10.857 3.909 -5.143 1.00 0.00 C ATOM 1840 CG1 VAL E 50 10.265 3.572 -6.512 1.00 0.00 C ATOM 1841 CG2 VAL E 50 12.384 3.969 -5.250 1.00 0.00 C ATOM 0 H VAL E 50 11.523 4.948 -2.943 1.00 0.00 H new ATOM 0 HA VAL E 50 10.484 6.004 -5.466 1.00 0.00 H new ATOM 0 HB VAL E 50 10.572 3.142 -4.423 1.00 0.00 H new ATOM 0 HG11 VAL E 50 10.643 2.605 -6.844 1.00 0.00 H new ATOM 0 HG12 VAL E 50 9.178 3.531 -6.438 1.00 0.00 H new ATOM 0 HG13 VAL E 50 10.552 4.339 -7.231 1.00 0.00 H new ATOM 0 HG21 VAL E 50 12.764 3.002 -5.580 1.00 0.00 H new ATOM 0 HG22 VAL E 50 12.668 4.736 -5.971 1.00 0.00 H new ATOM 0 HG23 VAL E 50 12.808 4.212 -4.276 1.00 0.00 H new ATOM 1851 N TYR E 51 8.062 6.111 -4.817 1.00 0.00 N ATOM 1852 CA TYR E 51 6.596 6.066 -4.568 1.00 0.00 C ATOM 1853 C TYR E 51 5.870 5.877 -5.900 1.00 0.00 C ATOM 1854 O TYR E 51 5.451 6.826 -6.531 1.00 0.00 O ATOM 1855 CB TYR E 51 6.148 7.380 -3.923 1.00 0.00 C ATOM 1856 CG TYR E 51 4.842 7.164 -3.196 1.00 0.00 C ATOM 1857 CD1 TYR E 51 3.696 6.796 -3.910 1.00 0.00 C ATOM 1858 CD2 TYR E 51 4.778 7.333 -1.808 1.00 0.00 C ATOM 1859 CE1 TYR E 51 2.485 6.597 -3.237 1.00 0.00 C ATOM 1860 CE2 TYR E 51 3.566 7.133 -1.134 1.00 0.00 C ATOM 1861 CZ TYR E 51 2.421 6.766 -1.850 1.00 0.00 C ATOM 1862 OH TYR E 51 1.226 6.568 -1.186 1.00 0.00 O ATOM 0 H TYR E 51 8.388 6.926 -5.337 1.00 0.00 H new ATOM 0 HA TYR E 51 6.360 5.238 -3.900 1.00 0.00 H new ATOM 0 HB2 TYR E 51 6.909 7.734 -3.228 1.00 0.00 H new ATOM 0 HB3 TYR E 51 6.029 8.150 -4.685 1.00 0.00 H new ATOM 0 HD1 TYR E 51 3.746 6.665 -4.981 1.00 0.00 H new ATOM 0 HD2 TYR E 51 5.662 7.617 -1.257 1.00 0.00 H new ATOM 0 HE1 TYR E 51 1.601 6.313 -3.788 1.00 0.00 H new ATOM 0 HE2 TYR E 51 3.515 7.262 -0.063 1.00 0.00 H new ATOM 0 HH TYR E 51 1.355 6.725 -0.227 1.00 0.00 H new ATOM 1872 N ALA E 52 5.726 4.657 -6.338 1.00 0.00 N ATOM 1873 CA ALA E 52 5.035 4.408 -7.635 1.00 0.00 C ATOM 1874 C ALA E 52 3.522 4.489 -7.431 1.00 0.00 C ATOM 1875 O ALA E 52 2.996 4.060 -6.423 1.00 0.00 O ATOM 1876 CB ALA E 52 5.405 3.016 -8.149 1.00 0.00 C ATOM 0 H ALA E 52 6.057 3.822 -5.855 1.00 0.00 H new ATOM 0 HA ALA E 52 5.344 5.159 -8.362 1.00 0.00 H new ATOM 0 HB1 ALA E 52 4.900 2.832 -9.098 1.00 0.00 H new ATOM 0 HB2 ALA E 52 6.484 2.957 -8.294 1.00 0.00 H new ATOM 0 HB3 ALA E 52 5.095 2.265 -7.422 1.00 0.00 H new ATOM 1882 N GLU E 53 2.817 5.037 -8.382 1.00 0.00 N ATOM 1883 CA GLU E 53 1.338 5.150 -8.246 1.00 0.00 C ATOM 1884 C GLU E 53 0.670 4.745 -9.564 1.00 0.00 C ATOM 1885 O GLU E 53 1.180 5.008 -10.636 1.00 0.00 O ATOM 1886 CB GLU E 53 0.967 6.597 -7.908 1.00 0.00 C ATOM 1887 CG GLU E 53 1.283 6.875 -6.437 1.00 0.00 C ATOM 1888 CD GLU E 53 1.934 8.254 -6.306 1.00 0.00 C ATOM 1889 OE1 GLU E 53 3.139 8.336 -6.477 1.00 0.00 O ATOM 1890 OE2 GLU E 53 1.217 9.203 -6.039 1.00 0.00 O ATOM 0 H GLU E 53 3.202 5.412 -9.249 1.00 0.00 H new ATOM 0 HA GLU E 53 0.995 4.491 -7.449 1.00 0.00 H new ATOM 0 HB2 GLU E 53 1.522 7.284 -8.546 1.00 0.00 H new ATOM 0 HB3 GLU E 53 -0.092 6.767 -8.102 1.00 0.00 H new ATOM 0 HG2 GLU E 53 0.369 6.835 -5.844 1.00 0.00 H new ATOM 0 HG3 GLU E 53 1.951 6.107 -6.046 1.00 0.00 H new ATOM 1897 N GLU E 54 -0.472 4.115 -9.493 1.00 0.00 N ATOM 1898 CA GLU E 54 -1.174 3.703 -10.740 1.00 0.00 C ATOM 1899 C GLU E 54 -2.189 4.780 -11.111 1.00 0.00 C ATOM 1900 O GLU E 54 -3.001 5.184 -10.301 1.00 0.00 O ATOM 1901 CB GLU E 54 -1.901 2.376 -10.519 1.00 0.00 C ATOM 1902 CG GLU E 54 -2.399 1.841 -11.862 1.00 0.00 C ATOM 1903 CD GLU E 54 -3.354 0.670 -11.623 1.00 0.00 C ATOM 1904 OE1 GLU E 54 -3.387 0.177 -10.508 1.00 0.00 O ATOM 1905 OE2 GLU E 54 -4.036 0.287 -12.559 1.00 0.00 O ATOM 0 H GLU E 54 -0.948 3.869 -8.625 1.00 0.00 H new ATOM 0 HA GLU E 54 -0.447 3.578 -11.542 1.00 0.00 H new ATOM 0 HB2 GLU E 54 -1.230 1.654 -10.053 1.00 0.00 H new ATOM 0 HB3 GLU E 54 -2.740 2.517 -9.837 1.00 0.00 H new ATOM 0 HG2 GLU E 54 -2.907 2.631 -12.414 1.00 0.00 H new ATOM 0 HG3 GLU E 54 -1.556 1.517 -12.472 1.00 0.00 H new ATOM 1912 N VAL E 55 -2.146 5.252 -12.325 1.00 0.00 N ATOM 1913 CA VAL E 55 -3.102 6.313 -12.744 1.00 0.00 C ATOM 1914 C VAL E 55 -3.433 6.135 -14.222 1.00 0.00 C ATOM 1915 O VAL E 55 -2.704 6.567 -15.092 1.00 0.00 O ATOM 1916 CB VAL E 55 -2.484 7.703 -12.517 1.00 0.00 C ATOM 1917 CG1 VAL E 55 -3.337 8.473 -11.509 1.00 0.00 C ATOM 1918 CG2 VAL E 55 -1.057 7.574 -11.968 1.00 0.00 C ATOM 0 H VAL E 55 -1.490 4.949 -13.045 1.00 0.00 H new ATOM 0 HA VAL E 55 -4.012 6.231 -12.150 1.00 0.00 H new ATOM 0 HB VAL E 55 -2.451 8.233 -13.469 1.00 0.00 H new ATOM 0 HG11 VAL E 55 -2.904 9.459 -11.344 1.00 0.00 H new ATOM 0 HG12 VAL E 55 -4.350 8.582 -11.897 1.00 0.00 H new ATOM 0 HG13 VAL E 55 -3.367 7.927 -10.566 1.00 0.00 H new ATOM 0 HG21 VAL E 55 -0.635 8.567 -11.814 1.00 0.00 H new ATOM 0 HG22 VAL E 55 -1.079 7.038 -11.019 1.00 0.00 H new ATOM 0 HG23 VAL E 55 -0.441 7.025 -12.681 1.00 0.00 H new ATOM 1928 N LYS E 56 -4.529 5.492 -14.513 1.00 0.00 N ATOM 1929 CA LYS E 56 -4.908 5.277 -15.936 1.00 0.00 C ATOM 1930 C LYS E 56 -6.435 5.216 -16.057 1.00 0.00 C ATOM 1931 O LYS E 56 -7.074 4.447 -15.366 1.00 0.00 O ATOM 1932 CB LYS E 56 -4.313 3.954 -16.416 1.00 0.00 C ATOM 1933 CG LYS E 56 -4.807 3.655 -17.832 1.00 0.00 C ATOM 1934 CD LYS E 56 -6.059 2.779 -17.764 1.00 0.00 C ATOM 1935 CE LYS E 56 -5.650 1.308 -17.682 1.00 0.00 C ATOM 1936 NZ LYS E 56 -6.350 0.662 -16.536 1.00 0.00 N ATOM 0 H LYS E 56 -5.178 5.106 -13.827 1.00 0.00 H new ATOM 0 HA LYS E 56 -4.528 6.098 -16.544 1.00 0.00 H new ATOM 0 HB2 LYS E 56 -3.224 4.007 -16.403 1.00 0.00 H new ATOM 0 HB3 LYS E 56 -4.601 3.148 -15.741 1.00 0.00 H new ATOM 0 HG2 LYS E 56 -5.030 4.585 -18.354 1.00 0.00 H new ATOM 0 HG3 LYS E 56 -4.027 3.149 -18.401 1.00 0.00 H new ATOM 0 HD2 LYS E 56 -6.658 3.050 -16.895 1.00 0.00 H new ATOM 0 HD3 LYS E 56 -6.681 2.946 -18.644 1.00 0.00 H new ATOM 0 HE2 LYS E 56 -5.902 0.797 -18.611 1.00 0.00 H new ATOM 0 HE3 LYS E 56 -4.570 1.226 -17.556 1.00 0.00 H new ATOM 0 HZ1 LYS E 56 -6.073 -0.339 -16.479 1.00 0.00 H new ATOM 0 HZ2 LYS E 56 -6.088 1.145 -15.653 1.00 0.00 H new ATOM 0 HZ3 LYS E 56 -7.378 0.729 -16.675 1.00 0.00 H new ATOM 1950 N PRO E 57 -6.978 6.023 -16.935 1.00 0.00 N ATOM 1951 CA PRO E 57 -8.431 6.070 -17.166 1.00 0.00 C ATOM 1952 C PRO E 57 -8.862 4.894 -18.048 1.00 0.00 C ATOM 1953 O PRO E 57 -8.140 4.474 -18.929 1.00 0.00 O ATOM 1954 CB PRO E 57 -8.636 7.402 -17.891 1.00 0.00 C ATOM 1955 CG PRO E 57 -7.274 7.763 -18.533 1.00 0.00 C ATOM 1956 CD PRO E 57 -6.202 6.959 -17.774 1.00 0.00 C ATOM 0 HA PRO E 57 -9.018 5.997 -16.250 1.00 0.00 H new ATOM 0 HB2 PRO E 57 -9.413 7.315 -18.651 1.00 0.00 H new ATOM 0 HB3 PRO E 57 -8.956 8.178 -17.195 1.00 0.00 H new ATOM 0 HG2 PRO E 57 -7.267 7.512 -19.594 1.00 0.00 H new ATOM 0 HG3 PRO E 57 -7.082 8.833 -18.457 1.00 0.00 H new ATOM 0 HD2 PRO E 57 -5.543 6.427 -18.460 1.00 0.00 H new ATOM 0 HD3 PRO E 57 -5.572 7.609 -17.167 1.00 0.00 H new ATOM 1964 N PHE E 58 -10.031 4.361 -17.820 1.00 0.00 N ATOM 1965 CA PHE E 58 -10.494 3.215 -18.652 1.00 0.00 C ATOM 1966 C PHE E 58 -11.816 3.586 -19.342 1.00 0.00 C ATOM 1967 O PHE E 58 -12.579 4.379 -18.828 1.00 0.00 O ATOM 1968 CB PHE E 58 -10.672 1.973 -17.757 1.00 0.00 C ATOM 1969 CG PHE E 58 -12.096 1.867 -17.254 1.00 0.00 C ATOM 1970 CD1 PHE E 58 -13.103 1.406 -18.110 1.00 0.00 C ATOM 1971 CD2 PHE E 58 -12.406 2.227 -15.937 1.00 0.00 C ATOM 1972 CE1 PHE E 58 -14.421 1.306 -17.651 1.00 0.00 C ATOM 1973 CE2 PHE E 58 -13.726 2.125 -15.477 1.00 0.00 C ATOM 1974 CZ PHE E 58 -14.733 1.664 -16.334 1.00 0.00 C ATOM 0 H PHE E 58 -10.682 4.668 -17.097 1.00 0.00 H new ATOM 0 HA PHE E 58 -9.754 2.987 -19.420 1.00 0.00 H new ATOM 0 HB2 PHE E 58 -10.413 1.075 -18.319 1.00 0.00 H new ATOM 0 HB3 PHE E 58 -9.987 2.029 -16.911 1.00 0.00 H new ATOM 0 HD1 PHE E 58 -12.863 1.127 -19.125 1.00 0.00 H new ATOM 0 HD2 PHE E 58 -11.629 2.583 -15.276 1.00 0.00 H new ATOM 0 HE1 PHE E 58 -15.198 0.953 -18.313 1.00 0.00 H new ATOM 0 HE2 PHE E 58 -13.967 2.402 -14.461 1.00 0.00 H new ATOM 0 HZ PHE E 58 -15.750 1.585 -15.979 1.00 0.00 H new ATOM 1984 N PRO E 59 -12.039 2.999 -20.491 1.00 0.00 N ATOM 1985 CA PRO E 59 -11.102 2.039 -21.100 1.00 0.00 C ATOM 1986 C PRO E 59 -9.937 2.779 -21.765 1.00 0.00 C ATOM 1987 O PRO E 59 -9.756 3.967 -21.578 1.00 0.00 O ATOM 1988 CB PRO E 59 -11.958 1.317 -22.144 1.00 0.00 C ATOM 1989 CG PRO E 59 -13.140 2.263 -22.468 1.00 0.00 C ATOM 1990 CD PRO E 59 -13.257 3.246 -21.288 1.00 0.00 C ATOM 0 HA PRO E 59 -10.655 1.357 -20.377 1.00 0.00 H new ATOM 0 HB2 PRO E 59 -11.377 1.100 -23.040 1.00 0.00 H new ATOM 0 HB3 PRO E 59 -12.318 0.363 -21.759 1.00 0.00 H new ATOM 0 HG2 PRO E 59 -12.963 2.798 -23.401 1.00 0.00 H new ATOM 0 HG3 PRO E 59 -14.064 1.699 -22.595 1.00 0.00 H new ATOM 0 HD2 PRO E 59 -13.305 4.279 -21.633 1.00 0.00 H new ATOM 0 HD3 PRO E 59 -14.159 3.063 -20.704 1.00 0.00 H new